N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide

C17H19N3O2 — CID 109203921

IUPACN-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
SMILESCOc1cccc(NC(=O)c2cc(N3CCCC3)ccn2)c1
InChIInChI=1S/C17H19N3O2/c1-22-15-6-4-5-13(11-15)19-17(21)16-12-14(7-8-18-16)20-9-2-3-10-20/h4-8,11-12H,2-3,9-10H2,1H3,(H,19,21)
InChIKeyXGGWPSVYACWZED-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.94
Rot. Bonds4

About N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide

N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide (PubChem CID 109203921) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
PubChem CID109203921
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
SMILESCOc1cccc(NC(=O)c2cc(N3CCCC3)ccn2)c1
InChIInChI=1S/C17H19N3O2/c1-22-15-6-4-5-13(11-15)19-17(21)16-12-14(7-8-18-16)20-9-2-3-10-20/h4-8,11-12H,2-3,9-10H2,1H3,(H,19,21)
InChIKeyXGGWPSVYACWZED-UHFFFAOYSA-N
XLogP2.94
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetylphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203933
N-(3-iodophenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 112773692
4-amino-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 55041968
N-(4-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
CID 109215246
N-(4-acetamidophenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203936
4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide
CID 99249750
N-(3-methoxyphenyl)-4-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109081751
N-(4-ethoxyphenyl)-4-piperidin-1-ylpyridine-2-carboxamide
CID 109204671
4-(azepan-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-2-carboxamide
CID 109218677
4-[4-(3-methoxyphenyl)piperazin-1-yl]pyridine-2-carboxamide
CID 133313294
4-N-(3-chlorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092816
4-(3-methoxyanilino)-N-phenylpyridine-2-carboxamide
CID 109218773

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide (CID 109203921) is N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide is COc1cccc(NC(=O)c2cc(N3CCCC3)ccn2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide?
The InChIKey is XGGWPSVYACWZED-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-22-15-6-4-5-13(11-15)19-17(21)16-12-14(7-8-18-16)20-9-2-3-10-20/h4-8,11-12H,2-3,9-10H2,1H3,(H,19,21).
What are the key properties of N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide?
N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide has a molecular weight of 297.36 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide is sourced from PubChem (CID 109203921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).