N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide

C151H197N39O14S3 — CID 160545579

IUPACN-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide
SMILESCCCN(CC1CC1)c1cc(C(=O)Nc2ccc(CN3CCC3)cc2C)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2cccc(Cn3ccnc3)c2)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2cccc(Cn3cncn3)c2)ncn1.CCCN(c1cc(C(=O)Nc2ccc3[nH]ncc3c2)ncn1)C1CCCCC1.COCCN(c1cc(C(=O)Nc2ccc(S(N)(=O)=O)cc2C)ncn1)C1CCCC1.Cc1cc(S(N)(=O)=O)ccc1NC(=O)c1cc(N(CC(C)C)C2CCCCC2)ncn1.Cc1cc(S(N)(=O)=O)ccc1NC(=O)c1cc(N(CC(C)C)C2CCCCC2)ncn1
InChIInChI=1S/C23H31N5O.C22H26N6O.2C22H31N5O3S.C21H25N7O.C21H26N6O.C20H27N5O4S/c1-3-9-28(15-18-5-6-18)22-13-21(24-16-25-22)23(29)26-20-8-7-19(12-17(20)2)14-27-10-4-11-27;1-2-9-28(14-17-6-7-17)21-12-20(24-15-25-21)22(29)26-19-5-3-4-18(11-19)13-27-10-8-23-16-27;2*1-15(2)13-27(17-7-5-4-6-8-17)21-12-20(24-14-25-21)22(28)26-19-10-9-18(11-16(19)3)31(23,29)30;1-2-8-27(11-16-6-7-16)20-10-19(23-14-24-20)21(29)26-18-5-3-4-17(9-18)12-28-15-22-13-25-28;1-2-10-27(17-6-4-3-5-7-17)20-12-19(22-14-23-20)21(28)25-16-8-9-18-15(11-16)13-24-26-18;1-14-11-16(30(21,27)28)7-8-17(14)24-20(26)18-12-19(23-13-22-18)25(9-10-29-2)15-5-3-4-6-15/h7-8,12-13,16,18H,3-6,9-11,14-15H2,1-2H3,(H,26,29);3-5,8,10-12,15-17H,2,6-7,9,13-14H2,1H3,(H,26,29);2*9-12,14-15,17H,4-8,13H2,1-3H3,(H,26,28)(H2,23,29,30);3-5,9-10,13-16H,2,6-8,11-12H2,1H3,(H,26,29);8-9,11-14,17H,2-7,10H2,1H3,(H,24,26)(H,25,28);7-8,11-13,15H,3-6,9-10H2,1-2H3,(H,24,26)(H2,21,27,28)
InChIKeyQXJQNONJBWIFIE-UHFFFAOYSA-N
MW2878.70 g/mol
LogP23.66
Rot. Bonds55

About N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide

N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide (PubChem CID 160545579) has the molecular formula C151H197N39O14S3 and a molecular weight of 2878.70 g/mol. Its IUPAC name is N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide
PubChem CID160545579
Molecular FormulaC151H197N39O14S3
Molecular Weight2878.70 g/mol
Exact Mass2876.51
IUPAC NameN-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide
SMILESCCCN(CC1CC1)c1cc(C(=O)Nc2ccc(CN3CCC3)cc2C)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2cccc(Cn3ccnc3)c2)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2cccc(Cn3cncn3)c2)ncn1.CCCN(c1cc(C(=O)Nc2ccc3[nH]ncc3c2)ncn1)C1CCCCC1.COCCN(c1cc(C(=O)Nc2ccc(S(N)(=O)=O)cc2C)ncn1)C1CCCC1.Cc1cc(S(N)(=O)=O)ccc1NC(=O)c1cc(N(CC(C)C)C2CCCCC2)ncn1.Cc1cc(S(N)(=O)=O)ccc1NC(=O)c1cc(N(CC(C)C)C2CCCCC2)ncn1
InChIInChI=1S/C23H31N5O.C22H26N6O.2C22H31N5O3S.C21H25N7O.C21H26N6O.C20H27N5O4S/c1-3-9-28(15-18-5-6-18)22-13-21(24-16-25-22)23(29)26-20-8-7-19(12-17(20)2)14-27-10-4-11-27;1-2-9-28(14-17-6-7-17)21-12-20(24-15-25-21)22(29)26-19-5-3-4-18(11-19)13-27-10-8-23-16-27;2*1-15(2)13-27(17-7-5-4-6-8-17)21-12-20(24-14-25-21)22(28)26-19-10-9-18(11-16(19)3)31(23,29)30;1-2-8-27(11-16-6-7-16)20-10-19(23-14-24-20)21(29)26-18-5-3-4-17(9-18)12-28-15-22-13-25-28;1-2-10-27(17-6-4-3-5-7-17)20-12-19(22-14-23-20)21(28)25-16-8-9-18-15(11-16)13-24-26-18;1-14-11-16(30(21,27)28)7-8-17(14)24-20(26)18-12-19(23-13-22-18)25(9-10-29-2)15-5-3-4-6-15/h7-8,12-13,16,18H,3-6,9-11,14-15H2,1-2H3,(H,26,29);3-5,8,10-12,15-17H,2,6-7,9,13-14H2,1H3,(H,26,29);2*9-12,14-15,17H,4-8,13H2,1-3H3,(H,26,28)(H2,23,29,30);3-5,9-10,13-16H,2,6-8,11-12H2,1H3,(H,26,29);8-9,11-14,17H,2-7,10H2,1H3,(H,24,26)(H,25,28);7-8,11-13,15H,3-6,9-10H2,1-2H3,(H,24,26)(H2,21,27,28)
InChIKeyQXJQNONJBWIFIE-UHFFFAOYSA-N
XLogP23.66
TPSA677.00 Ų
H-Bond Donors11
H-Bond Acceptors42
Rotatable Bonds55
Heavy Atoms207
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002878.70
LogP ≤ 523.66
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1042

Analyze N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide with MolForge

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Related Compounds

6-[cyclohexyl(cyclopropylmethyl)amino]-N-[4-[[3-(1-hydroxyethenyl)azetidin-1-yl]methyl]phenyl]pyrimidine-4-carboxamide;6-[cyclohexyl(cyclopropylmethyl)amino]-N-[2-methyl-4-[3-[(2-methylpropan-2-yl)oxy]but-3-enylsulfamoyl]phenyl]pyrimidine-4-carboxamide;6-[cyclohexyl(cyclopropylmethyl)amino]-N-[4-[[(2-methyl-3-oxopentan-2-yl)amino]methyl]phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(4-ethyl-2-methylphenyl)pyrimidine-4-carboxamide;N-(1H-indol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide
CID 158037836
2-[4-(aminomethyl)phenyl]-1-[6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidin-4-yl]ethanone;2-[4-(aminomethyl)phenyl]-1-[6-[cyclopropylmethyl(propyl)amino]pyrimidin-4-yl]ethanone;tert-butyl 3-[[4-[2-[6-[cyclohexyl(cyclopropylmethyl)amino]pyrimidin-4-yl]-2-oxoethyl]-3-methylphenyl]sulfonylamino]propanoate;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;2-(1H-indazol-5-yl)-1-[6-[2-methoxyethyl(propan-2-yl)amino]pyrimidin-4-yl]ethanone
CID 158460243
2-[4-(aminomethyl)phenyl]-1-[6-(dipropylamino)pyrimidin-4-yl]ethanone;6-[bis(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;tert-butyl 2-[[4-[[6-[cyclohexyl(cyclopropylmethyl)amino]pyrimidine-4-carbonyl]amino]phenyl]methylamino]acetate;1-[6-[cyclopentyl(2-methylpropyl)amino]pyrimidin-4-yl]-2-(1H-indazol-5-yl)ethanone;6-[cyclopropylmethyl(propyl)amino]-N-(6-methyl-1H-indazol-5-yl)pyrimidine-4-carboxamide
CID 158683769
6-[cyclohexyl(cyclopropylmethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclohexyl(methyl)amino]-N-[4-(3-methoxypropylsulfonyl)phenyl]pyrimidine-4-carboxamide;6-[cyclohexyl(methyl)amino]-N-(2-oxo-1,3-dihydroindol-5-yl)pyrimidine-4-carboxamide;6-[cyclohexyl(methyl)amino]-N-quinolin-4-ylpyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide
CID 160891376
2-[4-(aminomethyl)phenyl]-1-[6-[cyclohexyl(propyl)amino]pyrimidin-4-yl]ethanone;2-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-1-[6-[cyclopropylmethyl(propyl)amino]pyrimidin-4-yl]ethanone;1-[6-[cyclohexyl(cyclopropylmethyl)amino]pyrimidin-4-yl]-2-(6-methyl-1H-indazol-5-yl)ethanone;bis(4-[2-[6-[cyclohexyl(2-methylpropyl)amino]pyrimidin-4-yl]-2-oxoethyl]-3-methylbenzenesulfonamide);1-[6-[cyclohexyl(propyl)amino]pyrimidin-4-yl]-2-(1H-indazol-5-yl)ethanone;4-[2-[6-[cyclopentyl(2-methoxyethyl)amino]pyrimidin-4-yl]-2-oxoethyl]-3-methylbenzenesulfonamide
CID 161540851

Frequently Asked Questions

What is the IUPAC name of N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide?
The IUPAC name of N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide (CID 160545579) is N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide.
What is the SMILES notation for N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide?
The canonical SMILES for N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide is CCCN(CC1CC1)c1cc(C(=O)Nc2ccc(CN3CCC3)cc2C)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2cccc(Cn3ccnc3)c2)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2cccc(Cn3cncn3)c2)ncn1.CCCN(c1cc(C(=O)Nc2ccc3[nH]ncc3c2)ncn1)C1CCCCC1.COCCN(c1cc(C(=O)Nc2ccc(S(N)(=O)=O)cc2C)ncn1)C1CCCC1.Cc1cc(S(N)(=O)=O)ccc1NC(=O)c1cc(N(CC(C)C)C2CCCCC2)ncn1.Cc1cc(S(N)(=O)=O)ccc1NC(=O)c1cc(N(CC(C)C)C2CCCCC2)ncn1.
What is the InChIKey of N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide?
The InChIKey is QXJQNONJBWIFIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31N5O.C22H26N6O.2C22H31N5O3S.C21H25N7O.C21H26N6O.C20H27N5O4S/c1-3-9-28(15-18-5-6-18)22-13-21(24-16-25-22)23(29)26-20-8-7-19(12-17(20)2)14-27-10-4-11-27;1-2-9-28(14-17-6-7-17)21-12-20(24-15-25-21)22(29)26-19-5-3-4-18(11-19)13-27-10-8-23-16-27;2*1-15(2)13-27(17-7-5-4-6-8-17)21-12-20(24-14-25-21)22(28)26-19-10-9-18(11-16(19)3)31(23,29)30;1-2-8-27(11-16-6-7-16)20-10-19(23-14-24-20)21(29)26-18-5-3-4-17(9-18)12-28-15-22-13-25-28;1-2-10-27(17-6-4-3-5-7-17)20-12-19(22-14-23-20)21(28)25-16-8-9-18-15(11-16)13-24-26-18;1-14-11-16(30(21,27)28)7-8-17(14)24-20(26)18-12-19(23-13-22-18)25(9-10-29-2)15-5-3-4-6-15/h7-8,12-13,16,18H,3-6,9-11,14-15H2,1-2H3,(H,26,29);3-5,8,10-12,15-17H,2,6-7,9,13-14H2,1H3,(H,26,29);2*9-12,14-15,17H,4-8,13H2,1-3H3,(H,26,28)(H2,23,29,30);3-5,9-10,13-16H,2,6-8,11-12H2,1H3,(H,26,29);8-9,11-14,17H,2-7,10H2,1H3,(H,24,26)(H,25,28);7-8,11-13,15H,3-6,9-10H2,1-2H3,(H,24,26)(H2,21,27,28).
What are the key properties of N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide?
N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide has a molecular weight of 2878.70 g/mol, XLogP of 23.66, 55 rotatable bonds, 11 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(azetidin-1-ylmethyl)-2-methylphenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;bis(6-[cyclohexyl(2-methylpropyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide);6-[cyclohexyl(propyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopentyl(2-methoxyethyl)amino]-N-(2-methyl-4-sulfamoylphenyl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(imidazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-[3-(1,2,4-triazol-1-ylmethyl)phenyl]pyrimidine-4-carboxamide is sourced from PubChem (CID 160545579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).