6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide

C20H31N5O2 — CID 146150272

IUPAC6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)NCC(=O)NC3CCN(C)CC3)cn2)CC1
InChIInChI=1S/C20H31N5O2/c1-15-5-11-25(12-6-15)18-4-3-16(13-21-18)20(27)22-14-19(26)23-17-7-9-24(2)10-8-17/h3-4,13,15,17H,5-12,14H2,1-2H3,(H,22,27)(H,23,26)
InChIKeyNGUXOISQQZFDEZ-UHFFFAOYSA-N
MW373.50 g/mol
LogP1.26
Rot. Bonds5

About 6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide

6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide (PubChem CID 146150272) has the molecular formula C20H31N5O2 and a molecular weight of 373.50 g/mol. Its IUPAC name is 6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide
PubChem CID146150272
Molecular FormulaC20H31N5O2
Molecular Weight373.50 g/mol
Exact Mass373.25
IUPAC Name6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)NCC(=O)NC3CCN(C)CC3)cn2)CC1
InChIInChI=1S/C20H31N5O2/c1-15-5-11-25(12-6-15)18-4-3-16(13-21-18)20(27)22-14-19(26)23-17-7-9-24(2)10-8-17/h3-4,13,15,17H,5-12,14H2,1-2H3,(H,22,27)(H,23,26)
InChIKeyNGUXOISQQZFDEZ-UHFFFAOYSA-N
XLogP1.26
TPSA77.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide with MolForge

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Related Compounds

N-[2-(methylamino)propyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 120827370
N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 167828040
N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 111332971
N-(2-amino-2-ethylbutyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 119641202
N-(cyclohexylmethyl)-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamide
CID 25182094
N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 119528228
N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109152569
N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 146136407
5-N-[[6-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]pyridine-2,5-dicarboxamide
CID 86859111
4-amino-N-[2-[(4-methylcyclohexyl)amino]-2-oxoethyl]benzamide
CID 24692664
N-(1-methylpyrrolidin-3-yl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 72570198
N-[(3R)-1-methylpyrrolidin-3-yl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 59818085

Frequently Asked Questions

What is the IUPAC name of 6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide?
The IUPAC name of 6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide (CID 146150272) is 6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide?
The canonical SMILES for 6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide is CC1CCN(c2ccc(C(=O)NCC(=O)NC3CCN(C)CC3)cn2)CC1.
What is the InChIKey of 6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide?
The InChIKey is NGUXOISQQZFDEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N5O2/c1-15-5-11-25(12-6-15)18-4-3-16(13-21-18)20(27)22-14-19(26)23-17-7-9-24(2)10-8-17/h3-4,13,15,17H,5-12,14H2,1-2H3,(H,22,27)(H,23,26).
What are the key properties of 6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide?
6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide has a molecular weight of 373.50 g/mol, XLogP of 1.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide is sourced from PubChem (CID 146150272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).