1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane

C122H181FN24O14S6 — CID 159389692

IUPAC1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane
SMILESC.C.C.C.C.C.C.CC(C)(C)c1nc(-c2ccc(NS(C)(=O)=O)cc2)cnc1N.CC(C)(C)c1nc(-c2cccc(CS(=O)(=O)C3CC3)c2)cnc1N.CC(C)(C)c1nc(-c2cccc(CS(C)(=O)=O)c2)cnc1N.CC(C)(C)c1nc(-c2cncc(CS(C)(=O)=O)c2)cnc1N.CC(C)Oc1ccc(-c2cnc(N)c(C(C)(C)C)n2)cc1F.CN(C)S(=O)(=O)Cc1cccc(-c2cnc(N)c(C(C)(C)C)n2)c1.COc1ccc(-c2cnc(N)c(C(C)(C)C)n2)cc1CS(C)(=O)=O
InChIInChI=1S/C18H23N3O2S.C17H22FN3O.C17H24N4O2S.C17H23N3O3S.C16H21N3O2S.2C15H20N4O2S.7CH4/c1-18(2,3)16-17(19)20-10-15(21-16)13-6-4-5-12(9-13)11-24(22,23)14-7-8-14;1-10(2)22-14-7-6-11(8-12(14)18)13-9-20-16(19)15(21-13)17(3,4)5;1-17(2,3)15-16(18)19-10-14(20-15)13-8-6-7-12(9-13)11-24(22,23)21(4)5;1-17(2,3)15-16(18)19-9-13(20-15)11-6-7-14(23-4)12(8-11)10-24(5,21)22;1-16(2,3)14-15(17)18-9-13(19-14)12-7-5-6-11(8-12)10-22(4,20)21;1-15(2,3)13-14(16)18-8-12(19-13)11-5-10(6-17-7-11)9-22(4,20)21;1-15(2,3)13-14(16)17-9-12(18-13)10-5-7-11(8-6-10)19-22(4,20)21;;;;;;;/h4-6,9-10,14H,7-8,11H2,1-3H3,(H2,19,20);6-10H,1-5H3,(H2,19,20);6-10H,11H2,1-5H3,(H2,18,19);6-9H,10H2,1-5H3,(H2,18,19);5-9H,10H2,1-4H3,(H2,17,18);5-8H,9H2,1-4H3,(H2,16,18);5-9,19H,1-4H3,(H2,16,17);7*1H4
InChIKeyLLYLKWFJRRFALD-UHFFFAOYSA-N
MW2419.34 g/mol
LogP23.42
Rot. Bonds24

About 1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane

1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane (PubChem CID 159389692) has the molecular formula C122H181FN24O14S6 and a molecular weight of 2419.34 g/mol. Its IUPAC name is 1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane.

Molecular Properties

Compound Name1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane
PubChem CID159389692
Molecular FormulaC122H181FN24O14S6
Molecular Weight2419.34 g/mol
Exact Mass2417.25
IUPAC Name1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane
SMILESC.C.C.C.C.C.C.CC(C)(C)c1nc(-c2ccc(NS(C)(=O)=O)cc2)cnc1N.CC(C)(C)c1nc(-c2cccc(CS(=O)(=O)C3CC3)c2)cnc1N.CC(C)(C)c1nc(-c2cccc(CS(C)(=O)=O)c2)cnc1N.CC(C)(C)c1nc(-c2cncc(CS(C)(=O)=O)c2)cnc1N.CC(C)Oc1ccc(-c2cnc(N)c(C(C)(C)C)n2)cc1F.CN(C)S(=O)(=O)Cc1cccc(-c2cnc(N)c(C(C)(C)C)n2)c1.COc1ccc(-c2cnc(N)c(C(C)(C)C)n2)cc1CS(C)(=O)=O
InChIInChI=1S/C18H23N3O2S.C17H22FN3O.C17H24N4O2S.C17H23N3O3S.C16H21N3O2S.2C15H20N4O2S.7CH4/c1-18(2,3)16-17(19)20-10-15(21-16)13-6-4-5-12(9-13)11-24(22,23)14-7-8-14;1-10(2)22-14-7-6-11(8-12(14)18)13-9-20-16(19)15(21-13)17(3,4)5;1-17(2,3)15-16(18)19-10-14(20-15)13-8-6-7-12(9-13)11-24(22,23)21(4)5;1-17(2,3)15-16(18)19-9-13(20-15)11-6-7-14(23-4)12(8-11)10-24(5,21)22;1-16(2,3)14-15(17)18-9-13(19-14)12-7-5-6-11(8-12)10-22(4,20)21;1-15(2,3)13-14(16)18-8-12(19-13)11-5-10(6-17-7-11)9-22(4,20)21;1-15(2,3)13-14(16)17-9-12(18-13)10-5-7-11(8-6-10)19-22(4,20)21;;;;;;;/h4-6,9-10,14H,7-8,11H2,1-3H3,(H2,19,20);6-10H,1-5H3,(H2,19,20);6-10H,11H2,1-5H3,(H2,18,19);6-9H,10H2,1-5H3,(H2,18,19);5-9H,10H2,1-4H3,(H2,17,18);5-8H,9H2,1-4H3,(H2,16,18);5-9,19H,1-4H3,(H2,16,17);7*1H4
InChIKeyLLYLKWFJRRFALD-UHFFFAOYSA-N
XLogP23.42
TPSA614.06 Ų
H-Bond Donors8
H-Bond Acceptors36
Rotatable Bonds24
Heavy Atoms167
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002419.34
LogP ≤ 523.42
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1036

Analyze 1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-tert-butyl-3-(6-tert-butyl-5-methylpyrazin-2-yl)benzenesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]-2-methylpyrazine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]-2-methylpyrazine;3-tert-butyl-2-methyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazine;3-tert-butyl-2-methyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazine;1-[3-(6-tert-butyl-5-methylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(6-tert-butyl-5-methylpyrazin-2-yl)phenyl]methanesulfonamide
CID 157143026
4-[6-benzyl-5-(benzylsulfonylmethyl)pyrazin-2-yl]phenol;[4-[6-benzyl-5-(benzylsulfonylmethyl)pyrazin-2-yl]phenyl] acetate;[4-[6-benzyl-5-(benzylsulfonylmethyl)pyrazin-2-yl]phenyl]methanol;[4-[6-benzyl-5-[bis(benzylsulfonyl)amino]pyrazin-2-yl]phenyl] acetate;N-[3-benzyl-5-[4-(hydroxymethyl)phenyl]pyrazin-2-yl]-N-benzylsulfonyl-1-phenylmethanesulfonamide
CID 157821505
3-tert-butyl-5-(3-chloro-4-propan-2-yloxyphenyl)-2-methylpyrazine;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]-2-methylpyrazine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)-2-methylpyrazine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]-2-methylpyrazine;3-tert-butyl-2-methyl-5-(6-propan-2-yloxy-3-pyridinyl)pyrazine;N-[4-(6-tert-butyl-5-methylpyrazin-2-yl)phenyl]methanesulfonamide
CID 157848726
N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-(3-chloro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;3-tert-butyl-5-(6-propan-2-yloxy-3-pyridinyl)pyrazin-2-amine
CID 157999168
3-Tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]-2-methylpyrazine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)-2-methylpyrazine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]-2-methylpyrazine
CID 158966339
3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]-2-methylpyrazine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)-2-methylpyrazine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]-2-methylpyrazine;3-tert-butyl-2-methyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazine;N-[4-(6-tert-butyl-5-methylpyrazin-2-yl)phenyl]methanesulfonamide
CID 159037215
4-[6-benzyl-5-(benzylsulfonylmethyl)pyrazin-2-yl]phenol;[4-[6-benzyl-5-(benzylsulfonylmethyl)pyrazin-2-yl]phenyl] acetate;[4-[6-benzyl-5-(benzylsulfonylmethyl)pyrazin-2-yl]phenyl]methanol;[4-[6-benzyl-5-[bis(benzylsulfonyl)amino]pyrazin-2-yl]phenyl] acetate;[4-[6-benzyl-5-[bis(methylsulfonyl)amino]pyrazin-2-yl]phenyl] acetate;N-[3-benzyl-5-[4-(hydroxymethyl)phenyl]pyrazin-2-yl]-N-benzylsulfonyl-1-phenylmethanesulfonamide
CID 159419508
3-tert-butyl-5-(3-chloro-4-propan-2-yloxyphenyl)-2-methylpyrazine;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]-2-methylpyrazine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)-2-methylpyrazine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]-2-methylpyrazine;3-tert-butyl-2-methyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazine;N-[4-(6-tert-butyl-5-methylpyrazin-2-yl)phenyl]methanesulfonamide
CID 159520221
4-[6-benzyl-5-(benzylsulfonylmethyl)pyrazin-2-yl]phenol;[4-[6-benzyl-5-(benzylsulfonylmethyl)pyrazin-2-yl]phenyl] acetate;[4-[6-benzyl-5-(benzylsulfonylmethyl)pyrazin-2-yl]phenyl]methanol;N-[3-benzyl-5-[4-(hydroxymethyl)phenyl]pyrazin-2-yl]-N-benzylsulfonyl-1-phenylmethanesulfonamide
CID 159526410
3-Benzyl-2-(benzylsulfonylmethyl)-5-phenylpyrazine;[4-[6-benzyl-5-(benzylsulfonylmethyl)pyrazin-2-yl]phenyl] acetate;[4-[6-benzyl-5-(benzylsulfonylmethyl)pyrazin-2-yl]phenyl]methanol;[4-[6-benzyl-5-[bis(methylsulfonyl)amino]pyrazin-2-yl]phenyl] acetate;4-[6-benzyl-5-(methylsulfonylmethyl)pyrazin-2-yl]phenol
CID 160078268
3-tert-butyl-5-(3-chloro-4-propan-2-yloxyphenyl)-2-methylpyrazine;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]-2-methylpyrazine;3-tert-butyl-5-(3,4-dimethoxyphenyl)-2-methylpyrazine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)-2-methylpyrazine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]-2-methylpyrazine;3-tert-butyl-2-methyl-5-(6-propan-2-yloxy-3-pyridinyl)pyrazine;N-[4-(6-tert-butyl-5-methylpyrazin-2-yl)phenyl]methanesulfonamide
CID 161107204
N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-(3-chloro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(6-propan-2-yloxy-3-pyridinyl)pyrazin-2-amine
CID 161755492

Frequently Asked Questions

What is the IUPAC name of 1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane?
The IUPAC name of 1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane (CID 159389692) is 1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane.
What is the SMILES notation for 1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane?
The canonical SMILES for 1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane is C.C.C.C.C.C.C.CC(C)(C)c1nc(-c2ccc(NS(C)(=O)=O)cc2)cnc1N.CC(C)(C)c1nc(-c2cccc(CS(=O)(=O)C3CC3)c2)cnc1N.CC(C)(C)c1nc(-c2cccc(CS(C)(=O)=O)c2)cnc1N.CC(C)(C)c1nc(-c2cncc(CS(C)(=O)=O)c2)cnc1N.CC(C)Oc1ccc(-c2cnc(N)c(C(C)(C)C)n2)cc1F.CN(C)S(=O)(=O)Cc1cccc(-c2cnc(N)c(C(C)(C)C)n2)c1.COc1ccc(-c2cnc(N)c(C(C)(C)C)n2)cc1CS(C)(=O)=O.
What is the InChIKey of 1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane?
The InChIKey is LLYLKWFJRRFALD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2S.C17H22FN3O.C17H24N4O2S.C17H23N3O3S.C16H21N3O2S.2C15H20N4O2S.7CH4/c1-18(2,3)16-17(19)20-10-15(21-16)13-6-4-5-12(9-13)11-24(22,23)14-7-8-14;1-10(2)22-14-7-6-11(8-12(14)18)13-9-20-16(19)15(21-13)17(3,4)5;1-17(2,3)15-16(18)19-10-14(20-15)13-8-6-7-12(9-13)11-24(22,23)21(4)5;1-17(2,3)15-16(18)19-9-13(20-15)11-6-7-14(23-4)12(8-11)10-24(5,21)22;1-16(2,3)14-15(17)18-9-13(19-14)12-7-5-6-11(8-12)10-22(4,20)21;1-15(2,3)13-14(16)18-8-12(19-13)11-5-10(6-17-7-11)9-22(4,20)21;1-15(2,3)13-14(16)17-9-12(18-13)10-5-7-11(8-6-10)19-22(4,20)21;;;;;;;/h4-6,9-10,14H,7-8,11H2,1-3H3,(H2,19,20);6-10H,1-5H3,(H2,19,20);6-10H,11H2,1-5H3,(H2,18,19);6-9H,10H2,1-5H3,(H2,18,19);5-9H,10H2,1-4H3,(H2,17,18);5-8H,9H2,1-4H3,(H2,16,18);5-9,19H,1-4H3,(H2,16,17);7*1H4.
What are the key properties of 1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane?
1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane has a molecular weight of 2419.34 g/mol, XLogP of 23.42, 24 rotatable bonds, 8 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]-N,N-dimethylmethanesulfonamide;N-[4-(5-amino-6-tert-butylpyrazin-2-yl)phenyl]methanesulfonamide;3-tert-butyl-5-[3-(cyclopropylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-(3-fluoro-4-propan-2-yloxyphenyl)pyrazin-2-amine;3-tert-butyl-5-[4-methoxy-3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[3-(methylsulfonylmethyl)phenyl]pyrazin-2-amine;3-tert-butyl-5-[5-(methylsulfonylmethyl)-3-pyridinyl]pyrazin-2-amine;methane is sourced from PubChem (CID 159389692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).