2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide

C20H22N4O2 — CID 135524927

IUPAC2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide
SMILESNC(=O)c1ccc2[nH]c(O)c(-c3ccc(CN4CCCCC4)cn3)c2c1
InChIInChI=1S/C20H22N4O2/c21-19(25)14-5-7-16-15(10-14)18(20(26)23-16)17-6-4-13(11-22-17)12-24-8-2-1-3-9-24/h4-7,10-11,23,26H,1-3,8-9,12H2,(H2,21,25)
InChIKeyKQSWBBVYCYRPSD-UHFFFAOYSA-N
MW350.42 g/mol
LogP3.02
Rot. Bonds4

About 2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide

2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide (PubChem CID 135524927) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide.

Molecular Properties

Compound Name2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide
PubChem CID135524927
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide
SMILESNC(=O)c1ccc2[nH]c(O)c(-c3ccc(CN4CCCCC4)cn3)c2c1
InChIInChI=1S/C20H22N4O2/c21-19(25)14-5-7-16-15(10-14)18(20(26)23-16)17-6-4-13(11-22-17)12-24-8-2-1-3-9-24/h4-7,10-11,23,26H,1-3,8-9,12H2,(H2,21,25)
InChIKeyKQSWBBVYCYRPSD-UHFFFAOYSA-N
XLogP3.02
TPSA95.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 53.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-2-hydroxy-3-[5-[(4-methylpiperazin-1-yl)methyl]-2-pyridinyl]-1H-indole-5-carboxamide;dihydrochloride
CID 135451047
3-[[2-hydroxy-3-[5-(morpholin-4-ylmethyl)-2-pyridinyl]-1H-indole-5-carbonyl]amino]propane-1-sulfinic acid
CID 174495870
2-hydroxy-3-[5-(morpholin-4-ylmethyl)-2-pyridinyl]-N-[[4-(trifluoromethyl)phenyl]methyl]-1H-indole-5-carboxamide;hydrochloride
CID 135514495
3-[5-(morpholin-4-ylmethyl)-2-pyridinyl]-5-nitro-1H-indol-2-ol
CID 135856969
2-hydroxy-3-[5-(morpholin-4-ylmethyl)-2-pyridinyl]-N-[[4-(trifluoromethoxy)phenyl]methyl]-1H-indole-5-carboxamide;hydrochloride
CID 135423380
but-2-enedioic acid;6-(5-cyano-2-hydroxy-1H-indol-3-yl)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 173121140
2-hydroxy-3-[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridinyl]-1H-indole-6-carboxamide
CID 135545456
3,4-bis[4-(pyrrolidin-1-ylmethyl)phenoxy]benzamide
CID 169179173
2-[3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]phenyl]acetic acid
CID 155919687
3-[[4-(piperidin-1-ylmethyl)benzoyl]amino]benzamide
CID 53281808
5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381235
2-hydroxy-3-[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridinyl]-N-(2-sulfamoylethyl)-1H-indole-5-carboxamide
CID 135507566

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide?
The IUPAC name of 2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide (CID 135524927) is 2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide.
What is the SMILES notation for 2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide?
The canonical SMILES for 2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide is NC(=O)c1ccc2[nH]c(O)c(-c3ccc(CN4CCCCC4)cn3)c2c1.
What is the InChIKey of 2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide?
The InChIKey is KQSWBBVYCYRPSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c21-19(25)14-5-7-16-15(10-14)18(20(26)23-16)17-6-4-13(11-22-17)12-24-8-2-1-3-9-24/h4-7,10-11,23,26H,1-3,8-9,12H2,(H2,21,25).
What are the key properties of 2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide?
2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide has a molecular weight of 350.42 g/mol, XLogP of 3.02, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-[5-(piperidin-1-ylmethyl)-2-pyridinyl]-1H-indole-5-carboxamide is sourced from PubChem (CID 135524927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).