N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide

C17H19N3O2 — CID 56903538

IUPACN-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide
SMILESCOc1ncccc1NC(=O)c1ccccc1C1CCNC1
InChIInChI=1S/C17H19N3O2/c1-22-17-15(7-4-9-19-17)20-16(21)14-6-3-2-5-13(14)12-8-10-18-11-12/h2-7,9,12,18H,8,10-11H2,1H3,(H,20,21)
InChIKeyPOKLWSGJQCGFSH-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.42
Rot. Bonds4

About N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide

N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide (PubChem CID 56903538) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide.

Molecular Properties

Compound NameN-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide
PubChem CID56903538
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide
SMILESCOc1ncccc1NC(=O)c1ccccc1C1CCNC1
InChIInChI=1S/C17H19N3O2/c1-22-17-15(7-4-9-19-17)20-16(21)14-6-3-2-5-13(14)12-8-10-18-11-12/h2-7,9,12,18H,8,10-11H2,1H3,(H,20,21)
InChIKeyPOKLWSGJQCGFSH-UHFFFAOYSA-N
XLogP2.42
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-2-methoxy-5-methylphenyl)-2-[(3R)-pyrrolidin-3-yl]benzamide
CID 95720866
N-(2-bromophenyl)-2-methoxypyridine-3-carboxamide
CID 55023834
N-[4-(1H-pyrazol-4-yl)phenyl]-2-[(3R)-pyrrolidin-3-yl]benzamide
CID 95708930
1-(3,4-dihydro-2H-thiochromen-4-yl)-3-(2-methoxy-3-pyridinyl)urea
CID 51116670
N-[2-(hydroxymethyl)phenyl]-2-methoxypyridine-3-carboxamide
CID 61497876
N-[(5-methylpyrazin-2-yl)methyl]-2-[(3S)-pyrrolidin-3-yl]benzamide
CID 95726988
2,3-dimethoxy-4-pyrrolidin-3-ylpyridine
CID 84676139
1-(2-methoxy-3-pyridinyl)-3-[(3R)-2-oxopiperidin-3-yl]urea
CID 94796982
2-methoxy-N-[2-(4-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]pyridine-3-carboxamide
CID 131948110
2-methoxy-N-(3-piperidin-4-yloxypropyl)pyridine-3-carboxamide
CID 63869445
N-(2-methoxy-3-pyridinyl)-1H-pyrazole-4-carboxamide
CID 60973003
N-(3-acetamido-2-methylphenyl)-2-methoxypyridine-3-carboxamide
CID 33241731

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide?
The IUPAC name of N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide (CID 56903538) is N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide.
What is the SMILES notation for N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide?
The canonical SMILES for N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide is COc1ncccc1NC(=O)c1ccccc1C1CCNC1.
What is the InChIKey of N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide?
The InChIKey is POKLWSGJQCGFSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-22-17-15(7-4-9-19-17)20-16(21)14-6-3-2-5-13(14)12-8-10-18-11-12/h2-7,9,12,18H,8,10-11H2,1H3,(H,20,21).
What are the key properties of N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide?
N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide has a molecular weight of 297.36 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-3-pyridinyl)-2-pyrrolidin-3-ylbenzamide is sourced from PubChem (CID 56903538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).