N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide

C19H23N3O2 — CID 135119211

IUPACN-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(N2CCC(O)(c3ccccc3C)C2)nc1
InChIInChI=1S/C19H23N3O2/c1-3-20-18(23)15-8-9-17(21-12-15)22-11-10-19(24,13-22)16-7-5-4-6-14(16)2/h4-9,12,24H,3,10-11,13H2,1-2H3,(H,20,23)
InChIKeyQPJIEKMIXARBCY-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.24
Rot. Bonds4

About N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide

N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide (PubChem CID 135119211) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide
PubChem CID135119211
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(N2CCC(O)(c3ccccc3C)C2)nc1
InChIInChI=1S/C19H23N3O2/c1-3-20-18(23)15-8-9-17(21-12-15)22-11-10-19(24,13-22)16-7-5-4-6-14(16)2/h4-9,12,24H,3,10-11,13H2,1-2H3,(H,20,23)
InChIKeyQPJIEKMIXARBCY-UHFFFAOYSA-N
XLogP2.24
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[3-(2-chlorophenyl)-3-hydroxypyrrolidin-1-yl]pyridine-3-carboxylic acid
CID 121427679
(3R)-1-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]-3-(2-methylphenyl)pyrrolidin-3-ol
CID 95891551
2-[4-[(3S)-3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyrimidin-5-yl]acetic acid
CID 97205561
[6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 135116874
6-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-ethylpyridine-3-carboxamide
CID 135101927
N-ethyl-6-[(3R)-3-phenylpiperazin-1-yl]pyridine-3-carboxamide
CID 95105098
6-[(1S,5S)-6-benzyl-3,6-diazabicyclo[3.2.2]nonan-3-yl]-N-ethylpyridine-3-carboxamide
CID 133121148
6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide
CID 134699696
N-ethyl-6-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)pyridine-3-carboxamide
CID 133422541
N-[2-(ethylamino)ethyl]-6-pyrrolidin-1-ylpyridine-3-carboxamide
CID 119505612
5-[5-(ethylcarbamoyl)-2-pyridinyl]-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-2-carboxylic acid
CID 50957600
6-(3-hydroxy-3-methylpyrrolidin-1-yl)pyridine-3-carboxylic acid
CID 103356410

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide?
The IUPAC name of N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide (CID 135119211) is N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide?
The canonical SMILES for N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide is CCNC(=O)c1ccc(N2CCC(O)(c3ccccc3C)C2)nc1.
What is the InChIKey of N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide?
The InChIKey is QPJIEKMIXARBCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-3-20-18(23)15-8-9-17(21-12-15)22-11-10-19(24,13-22)16-7-5-4-6-14(16)2/h4-9,12,24H,3,10-11,13H2,1-2H3,(H,20,23).
What are the key properties of N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide?
N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 135119211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).