N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide

C19H23N3O3 — CID 95570380

IUPACN-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCOc1ccccc1[C@H](CNC(=O)c1ccc(=O)[nH]c1)N1CCCC1
InChIInChI=1S/C19H23N3O3/c1-25-17-7-3-2-6-15(17)16(22-10-4-5-11-22)13-21-19(24)14-8-9-18(23)20-12-14/h2-3,6-9,12,16H,4-5,10-11,13H2,1H3,(H,20,23)(H,21,24)/t16-/m0/s1
InChIKeyWRVUPHTXXRAYKB-INIZCTEOSA-N
MW341.41 g/mol
LogP1.95
Rot. Bonds6

About N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide

N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 95570380) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide
PubChem CID95570380
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCOc1ccccc1[C@H](CNC(=O)c1ccc(=O)[nH]c1)N1CCCC1
InChIInChI=1S/C19H23N3O3/c1-25-17-7-3-2-6-15(17)16(22-10-4-5-11-22)13-21-19(24)14-8-9-18(23)20-12-14/h2-3,6-9,12,16H,4-5,10-11,13H2,1H3,(H,20,23)(H,21,24)/t16-/m0/s1
InChIKeyWRVUPHTXXRAYKB-INIZCTEOSA-N
XLogP1.95
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide with MolForge

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Related Compounds

methyl 4-[[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]carbamoyl]benzoate
CID 60533855
3-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-4-methylbenzamide
CID 60533969
N-[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]furan-3-carboxamide
CID 30522983
2-iodo-N-[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 31307195
3-fluoro-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-methylbenzamide
CID 43044899
N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-pyrrolidin-1-ylsulfonylbenzamide
CID 41187538
3-fluoro-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 43006303
3-chloro-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 46422201
N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 86911967
N-[2-[[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]amino]-2-oxoethyl]benzamide
CID 34937128
3,4,5-trimethoxy-N-[(2S)-2-naphthalen-1-yl-2-pyrrolidin-1-ylethyl]benzamide
CID 41453918
N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-4-(propan-2-ylcarbamoylamino)benzamide
CID 55950109

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide (CID 95570380) is N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide is COc1ccccc1[C@H](CNC(=O)c1ccc(=O)[nH]c1)N1CCCC1.
What is the InChIKey of N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is WRVUPHTXXRAYKB-INIZCTEOSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-25-17-7-3-2-6-15(17)16(22-10-4-5-11-22)13-21-19(24)14-8-9-18(23)20-12-14/h2-3,6-9,12,16H,4-5,10-11,13H2,1H3,(H,20,23)(H,21,24)/t16-/m0/s1.
What are the key properties of N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide?
N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 1.95, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 95570380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).