N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine

C132H153N45O18S7 — CID 159869947

IUPACN,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine
SMILESCC(=O)NC1CCN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CC(C)(O)C1CCN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CC(C)(O)C1CN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CN(C)C1(C)CN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CN(C)C1CCN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CS(=O)(=O)c1cccc(-c2ccc(CC3CCNC3)nc2)c1-c1nn[nH]n1.CS(=O)(=O)c1cccc(-c2ccc(N3CCC(CO)C3)nc2)c1-c1nn[nH]n1
InChIInChI=1S/C20H24N6O3S.C19H21N7O3S.2C19H23N7O2S.C19H22N6O3S.C18H20N6O3S.C18H20N6O2S/c1-20(2,27)14-9-10-26(12-14)17-8-7-13(11-21-17)15-5-4-6-16(30(3,28)29)18(15)19-22-24-25-23-19;1-12(27)21-14-8-9-26(11-14)17-7-6-13(10-20-17)15-4-3-5-16(30(2,28)29)18(15)19-22-24-25-23-19;1-19(25(2)3)11-26(12-19)16-9-8-13(10-20-16)14-6-5-7-15(29(4,27)28)17(14)18-21-23-24-22-18;1-25(2)14-9-10-26(12-14)17-8-7-13(11-20-17)15-5-4-6-16(29(3,27)28)18(15)19-21-23-24-22-19;1-19(2,26)13-10-25(11-13)16-8-7-12(9-20-16)14-5-4-6-15(29(3,27)28)17(14)18-21-23-24-22-18;1-28(26,27)15-4-2-3-14(17(15)18-20-22-23-21-18)13-5-6-16(19-9-13)24-8-7-12(10-24)11-25;1-27(25,26)16-4-2-3-15(17(16)18-21-23-24-22-18)13-5-6-14(20-11-13)9-12-7-8-19-10-12/h4-8,11,14,27H,9-10,12H2,1-3H3,(H,22,23,24,25);3-7,10,14H,8-9,11H2,1-2H3,(H,21,27)(H,22,23,24,25);5-10H,11-12H2,1-4H3,(H,21,22,23,24);4-8,11,14H,9-10,12H2,1-3H3,(H,21,22,23,24);4-9,13,26H,10-11H2,1-3H3,(H,21,22,23,24);2-6,9,12,25H,7-8,10-11H2,1H3,(H,20,21,22,23);2-6,11-12,19H,7-10H2,1H3,(H,21,22,23,24)
InChIKeyNSFFVRXFTDMDNW-UHFFFAOYSA-N
MW2882.44 g/mol
LogP10.10
Rot. Bonds35

About N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine

N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine (PubChem CID 159869947) has the molecular formula C132H153N45O18S7 and a molecular weight of 2882.44 g/mol. Its IUPAC name is N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine
PubChem CID159869947
Molecular FormulaC132H153N45O18S7
Molecular Weight2882.44 g/mol
Exact Mass2880.05
IUPAC NameN,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine
SMILESCC(=O)NC1CCN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CC(C)(O)C1CCN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CC(C)(O)C1CN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CN(C)C1(C)CN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CN(C)C1CCN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CS(=O)(=O)c1cccc(-c2ccc(CC3CCNC3)nc2)c1-c1nn[nH]n1.CS(=O)(=O)c1cccc(-c2ccc(N3CCC(CO)C3)nc2)c1-c1nn[nH]n1
InChIInChI=1S/C20H24N6O3S.C19H21N7O3S.2C19H23N7O2S.C19H22N6O3S.C18H20N6O3S.C18H20N6O2S/c1-20(2,27)14-9-10-26(12-14)17-8-7-13(11-21-17)15-5-4-6-16(30(3,28)29)18(15)19-22-24-25-23-19;1-12(27)21-14-8-9-26(11-14)17-7-6-13(10-20-17)15-4-3-5-16(30(2,28)29)18(15)19-22-24-25-23-19;1-19(25(2)3)11-26(12-19)16-9-8-13(10-20-16)14-6-5-7-15(29(4,27)28)17(14)18-21-23-24-22-18;1-25(2)14-9-10-26(12-14)17-8-7-13(11-20-17)15-5-4-6-16(29(3,27)28)18(15)19-21-23-24-22-19;1-19(2,26)13-10-25(11-13)16-8-7-12(9-20-16)14-5-4-6-15(29(3,27)28)17(14)18-21-23-24-22-18;1-28(26,27)15-4-2-3-14(17(15)18-20-22-23-21-18)13-5-6-16(19-9-13)24-8-7-12(10-24)11-25;1-27(25,26)16-4-2-3-15(17(16)18-21-23-24-22-18)13-5-6-14(20-11-13)9-12-7-8-19-10-12/h4-8,11,14,27H,9-10,12H2,1-3H3,(H,22,23,24,25);3-7,10,14H,8-9,11H2,1-2H3,(H,21,27)(H,22,23,24,25);5-10H,11-12H2,1-4H3,(H,21,22,23,24);4-8,11,14H,9-10,12H2,1-3H3,(H,21,22,23,24);4-9,13,26H,10-11H2,1-3H3,(H,21,22,23,24);2-6,9,12,25H,7-8,10-11H2,1H3,(H,20,21,22,23);2-6,11-12,19H,7-10H2,1H3,(H,21,22,23,24)
InChIKeyNSFFVRXFTDMDNW-UHFFFAOYSA-N
XLogP10.10
TPSA838.17 Ų
H-Bond Donors12
H-Bond Acceptors55
Rotatable Bonds35
Heavy Atoms202
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002882.44
LogP ≤ 510.10
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1055

Analyze N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine with MolForge

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Related Compounds

1-[(1-methylimidazol-2-yl)methyl]-4-[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]piperidine;1-[(3-methylimidazol-4-yl)methyl]-4-[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]piperidine;(2R)-2-[[4-[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]piperidin-1-yl]methyl]morpholine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol
CID 157485019
1-hydroxy-3-[[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methylamino]propan-2-one;N-[(1-methylimidazol-4-yl)methyl]-1-[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methanamine;N-methyl-1-[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methanamine;1-methyl-N-[[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]azetidin-3-amine;1-methyl-4-[[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]piperazine;1-methyl-N-[[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrrolidin-3-amine;N-[[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-2-pyrrolidin-1-ylethanamine
CID 157905789
1-hydroxy-3-[[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methylamino]propan-2-one;N-[(1-methylimidazol-4-yl)methyl]-1-[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methanamine;N-methyl-1-[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methanamine;2-[methyl-[[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]ethanol;1-methyl-N-[[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]azetidin-3-amine;1-methyl-N-[[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrrolidin-3-amine;2-[1-[[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]azetidin-3-yl]propan-2-ol
CID 158136670
1-methyl-4-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]-2,3,3a,5,6,6a-hexahydropyrrolo[3,2-b]pyrrole;N-methyl-5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine;2-(3-methylsulfonylazetidin-1-yl)-5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]pyridine;3-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]propan-1-amine;1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-[3-(pyrrolidin-1-ylmethyl)azetidin-1-yl]pyridine
CID 159731087
2-[2-(azetidin-2-yl)ethyl]-5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]pyridine;N',N'-dimethyl-N-[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-1,3-benzothiazol-2-yl]ethane-1,2-diamine;N,N'-dimethyl-N'-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]ethane-1,2-diamine;3-methyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-ol;N'-[4-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-1,3-benzothiazol-2-yl]ethane-1,2-diamine;[(2R)-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-2-yl]methanol
CID 160186464
3-methyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-ol;7-methyl-2-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]-2,7-diazaspiro[4.4]nonane;2-(3-methylsulfonylazetidin-1-yl)-5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]pyridine;[(2R)-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-2-yl]methanol;3-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]propan-1-amine;1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-ol
CID 160942971
N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;N-methyl-5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-[3-(pyrrolidin-1-ylmethyl)azetidin-1-yl]pyridine;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine
CID 161681437

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine?
The IUPAC name of N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine (CID 159869947) is N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine.
What is the SMILES notation for N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine?
The canonical SMILES for N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine is CC(=O)NC1CCN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CC(C)(O)C1CCN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CC(C)(O)C1CN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CN(C)C1(C)CN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CN(C)C1CCN(c2ccc(-c3cccc(S(C)(=O)=O)c3-c3nn[nH]n3)cn2)C1.CS(=O)(=O)c1cccc(-c2ccc(CC3CCNC3)nc2)c1-c1nn[nH]n1.CS(=O)(=O)c1cccc(-c2ccc(N3CCC(CO)C3)nc2)c1-c1nn[nH]n1.
What is the InChIKey of N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine?
The InChIKey is NSFFVRXFTDMDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O3S.C19H21N7O3S.2C19H23N7O2S.C19H22N6O3S.C18H20N6O3S.C18H20N6O2S/c1-20(2,27)14-9-10-26(12-14)17-8-7-13(11-21-17)15-5-4-6-16(30(3,28)29)18(15)19-22-24-25-23-19;1-12(27)21-14-8-9-26(11-14)17-7-6-13(10-20-17)15-4-3-5-16(30(2,28)29)18(15)19-22-24-25-23-19;1-19(25(2)3)11-26(12-19)16-9-8-13(10-20-16)14-6-5-7-15(29(4,27)28)17(14)18-21-23-24-22-18;1-25(2)14-9-10-26(12-14)17-8-7-13(11-20-17)15-5-4-6-16(29(3,27)28)18(15)19-21-23-24-22-19;1-19(2,26)13-10-25(11-13)16-8-7-12(9-20-16)14-5-4-6-15(29(3,27)28)17(14)18-21-23-24-22-18;1-28(26,27)15-4-2-3-14(17(15)18-20-22-23-21-18)13-5-6-16(19-9-13)24-8-7-12(10-24)11-25;1-27(25,26)16-4-2-3-15(17(16)18-21-23-24-22-18)13-5-6-14(20-11-13)9-12-7-8-19-10-12/h4-8,11,14,27H,9-10,12H2,1-3H3,(H,22,23,24,25);3-7,10,14H,8-9,11H2,1-2H3,(H,21,27)(H,22,23,24,25);5-10H,11-12H2,1-4H3,(H,21,22,23,24);4-8,11,14H,9-10,12H2,1-3H3,(H,21,22,23,24);4-9,13,26H,10-11H2,1-3H3,(H,21,22,23,24);2-6,9,12,25H,7-8,10-11H2,1H3,(H,20,21,22,23);2-6,11-12,19H,7-10H2,1H3,(H,21,22,23,24).
What are the key properties of N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine?
N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine has a molecular weight of 2882.44 g/mol, XLogP of 10.10, 35 rotatable bonds, 12 hydrogen bond donors, and 55 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-amine;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-yl]propan-2-ol;N-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]acetamide;[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]methanol;2-[1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]pyrrolidin-3-yl]propan-2-ol;5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-(pyrrolidin-3-ylmethyl)pyridine;N,N,3-trimethyl-1-[5-[3-methylsulfonyl-2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]azetidin-3-amine is sourced from PubChem (CID 159869947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).