N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide

C16H18N4O2 — CID 75462306

IUPACN-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide
SMILESCn1cc(NC(=O)N2CCCC2c2ccccn2)ccc1=O
InChIInChI=1S/C16H18N4O2/c1-19-11-12(7-8-15(19)21)18-16(22)20-10-4-6-14(20)13-5-2-3-9-17-13/h2-3,5,7-9,11,14H,4,6,10H2,1H3,(H,18,22)
InChIKeyNUSLVBMEMSLNHH-UHFFFAOYSA-N
MW298.35 g/mol
LogP2.15
Rot. Bonds2

About N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide

N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide (PubChem CID 75462306) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide
PubChem CID75462306
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC NameN-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide
SMILESCn1cc(NC(=O)N2CCCC2c2ccccn2)ccc1=O
InChIInChI=1S/C16H18N4O2/c1-19-11-12(7-8-15(19)21)18-16(22)20-10-4-6-14(20)13-5-2-3-9-17-13/h2-3,5,7-9,11,14H,4,6,10H2,1H3,(H,18,22)
InChIKeyNUSLVBMEMSLNHH-UHFFFAOYSA-N
XLogP2.15
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(propan-2-yl)-N'-(pyridin-2-ylmethyl)ethanediamide
CID 2053858
N-(pyridin-2-ylmethyl)acetamide
CID 5084090
(5E)-1-benzyl-5-[(1-methylpyrrol-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
CID 1916319
1-Cyclohexyl-3-(1-picolinoylpiperidin-4-yl)urea
CID 25070137
2(1H)-Pyridinone, 5-ethyl-6-methyl-3-((2-pyridinylmethyl)amino)-
CID 454397
1-allyl-5-[(1-methyl-1H-pyrrol-2-yl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
CID 880049
1-benzyl-5-[(1-methyl-1H-pyrrol-2-yl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
CID 919550
2-[5-oxo-1-(prop-2-en-1-yl)-3-(pyridin-2-ylmethyl)-2-thioxoimidazolidin-4-yl]-N-phenylacetamide
CID 4918667
(5E)-1-[2-(cyclohexen-1-yl)ethyl]-5-[(1-methylpyrrol-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
CID 5419454
2-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-N-(2-(pyridin-2-yl)ethyl)acetamide
CID 45280797
1-(Piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one
CID 46881467
1-[1-[2-(7-Fluoro-2-oxo-1,5-naphthyridin-1-yl)ethyl]piperidin-4-yl]-3-phenylurea
CID 118712933

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide?
The IUPAC name of N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide (CID 75462306) is N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide.
What is the SMILES notation for N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide?
The canonical SMILES for N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide is Cn1cc(NC(=O)N2CCCC2c2ccccn2)ccc1=O.
What is the InChIKey of N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide?
The InChIKey is NUSLVBMEMSLNHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c1-19-11-12(7-8-15(19)21)18-16(22)20-10-4-6-14(20)13-5-2-3-9-17-13/h2-3,5,7-9,11,14H,4,6,10H2,1H3,(H,18,22).
What are the key properties of N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide?
N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-6-oxo-3-pyridinyl)-2-pyridin-2-ylpyrrolidine-1-carboxamide is sourced from PubChem (CID 75462306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).