N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide

C14H21N3O2 — CID 107261834

IUPACN-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESCC(CNC(=O)c1cccc(=O)[nH]1)CN1CCCC1
InChIInChI=1S/C14H21N3O2/c1-11(10-17-7-2-3-8-17)9-15-14(19)12-5-4-6-13(18)16-12/h4-6,11H,2-3,7-10H2,1H3,(H,15,19)(H,16,18)
InChIKeyOIQQTILMYRQCDK-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.84
Rot. Bonds5

About N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide

N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 107261834) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide
PubChem CID107261834
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESCC(CNC(=O)c1cccc(=O)[nH]1)CN1CCCC1
InChIInChI=1S/C14H21N3O2/c1-11(10-17-7-2-3-8-17)9-15-14(19)12-5-4-6-13(18)16-12/h4-6,11H,2-3,7-10H2,1H3,(H,15,19)(H,16,18)
InChIKeyOIQQTILMYRQCDK-UHFFFAOYSA-N
XLogP0.84
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-carboxamide
CID 47292410
N-[2-(azepan-1-yl)-2-phenylethyl]-6-oxo-1H-pyridine-2-carboxamide
CID 131895345
6-oxo-N-(2-oxo-2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide
CID 107261944
3-hydroxy-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 62992034
2-amino-6-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 62993945
2-amino-6-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 61140232
N-[2-[cyclopropyl(methyl)amino]propyl]-6-oxo-1H-pyridine-2-carboxamide
CID 107363047
3,5-dihydroxy-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 103892120
N-(4-chloropentyl)-6-oxo-1H-pyridine-2-carboxamide
CID 106129299
3-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide
CID 55982254
5-bromo-N-(2-methyl-3-pyrrolidin-1-ylpropyl)thiophene-3-carboxamide
CID 61061664
N-(2-methyl-3-pyrrolidin-1-ylpropyl)acetamide
CID 61062993

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide (CID 107261834) is N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide is CC(CNC(=O)c1cccc(=O)[nH]1)CN1CCCC1.
What is the InChIKey of N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is OIQQTILMYRQCDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-11(10-17-7-2-3-8-17)9-15-14(19)12-5-4-6-13(18)16-12/h4-6,11H,2-3,7-10H2,1H3,(H,15,19)(H,16,18).
What are the key properties of N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide?
N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 0.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 107261834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).