4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide

C17H24N4O3S — CID 130416260

IUPAC4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide
SMILESCc1[nH]c2c(C(N)=O)ccc(N3CCCC(NS(C)(=O)=O)C3)c2c1C
InChIInChI=1S/C17H24N4O3S/c1-10-11(2)19-16-13(17(18)22)6-7-14(15(10)16)21-8-4-5-12(9-21)20-25(3,23)24/h6-7,12,19-20H,4-5,8-9H2,1-3H3,(H2,18,22)
InChIKeyTVXXXUPYKAOGGK-UHFFFAOYSA-N
MW364.47 g/mol
LogP1.40
Rot. Bonds4

About 4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide

4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide (PubChem CID 130416260) has the molecular formula C17H24N4O3S and a molecular weight of 364.47 g/mol. Its IUPAC name is 4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide.

Molecular Properties

Compound Name4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide
PubChem CID130416260
Molecular FormulaC17H24N4O3S
Molecular Weight364.47 g/mol
Exact Mass364.16
IUPAC Name4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide
SMILESCc1[nH]c2c(C(N)=O)ccc(N3CCCC(NS(C)(=O)=O)C3)c2c1C
InChIInChI=1S/C17H24N4O3S/c1-10-11(2)19-16-13(17(18)22)6-7-14(15(10)16)21-8-4-5-12(9-21)20-25(3,23)24/h6-7,12,19-20H,4-5,8-9H2,1-3H3,(H2,18,22)
InChIKeyTVXXXUPYKAOGGK-UHFFFAOYSA-N
XLogP1.40
TPSA108.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.47
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide with MolForge

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Related Compounds

2,3-dimethyl-4-[3-(prop-2-ynoylamino)piperidin-1-yl]-1H-indole-7-carboxamide
CID 121294025
2,3-dimethyl-4-[3-(prop-2-ynoylamino)pyrrolidin-1-yl]-1H-indole-7-carboxamide
CID 121294036
4-[3-[but-2-ynoyl(methyl)amino]piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide
CID 121293852
benzyl N-[(3S)-1-(7-cyano-2,3-dimethyl-1H-indol-4-yl)piperidin-3-yl]carbamate
CID 121300339
tert-butyl N-[1-(7-carbamoyl-5-fluoro-2,3-dimethyl-1H-indol-4-yl)piperidin-3-yl]carbamate
CID 170639735
N-[(3R)-1-(2-fluoro-5-methylphenyl)piperidin-3-yl]methanesulfonamide
CID 95629495
2,3-dimethyl-4-[[(3R)-pyrrolidin-3-yl]amino]-1H-indole-7-carboxamide
CID 121293848
N-[1-(4-methylsulfonylphenyl)piperidin-3-yl]methanesulfonamide
CID 163354197
4-[(3R)-3-acetamidopiperidin-1-yl]-7-(4-methylpiperazine-1-carbonyl)-9H-carbazole-1-carboxamide
CID 59375108
2,3-dimethyl-4-[[(3R)-1-prop-2-enoylpyrrolidin-3-yl]amino]-1H-indole-7-carboxamide
CID 121294112
1-(2,3-dimethyl-1H-indol-4-yl)-N-methylpiperidin-3-amine
CID 151199969
2,3-dimethyl-4-(1-prop-2-enoylpyrrolidin-3-yl)-1H-indole-7-carboxamide
CID 121293914

Frequently Asked Questions

What is the IUPAC name of 4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide?
The IUPAC name of 4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide (CID 130416260) is 4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide.
What is the SMILES notation for 4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide?
The canonical SMILES for 4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide is Cc1[nH]c2c(C(N)=O)ccc(N3CCCC(NS(C)(=O)=O)C3)c2c1C.
What is the InChIKey of 4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide?
The InChIKey is TVXXXUPYKAOGGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O3S/c1-10-11(2)19-16-13(17(18)22)6-7-14(15(10)16)21-8-4-5-12(9-21)20-25(3,23)24/h6-7,12,19-20H,4-5,8-9H2,1-3H3,(H2,18,22).
What are the key properties of 4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide?
4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide has a molecular weight of 364.47 g/mol, XLogP of 1.40, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(methanesulfonamido)piperidin-1-yl]-2,3-dimethyl-1H-indole-7-carboxamide is sourced from PubChem (CID 130416260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).