1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide

C19H21FN2O3 — CID 172665801

IUPAC1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide
SMILESCc1ccn(C2CC2)c(=O)c1C(=O)N(CCO)Cc1ccc(F)cc1
InChIInChI=1S/C19H21FN2O3/c1-13-8-9-22(16-6-7-16)19(25)17(13)18(24)21(10-11-23)12-14-2-4-15(20)5-3-14/h2-5,8-9,16,23H,6-7,10-12H2,1H3
InChIKeyCESLPSODELDPRB-UHFFFAOYSA-N
MW344.39 g/mol
LogP2.27
Rot. Bonds6

About 1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide

1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide (PubChem CID 172665801) has the molecular formula C19H21FN2O3 and a molecular weight of 344.39 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide
PubChem CID172665801
Molecular FormulaC19H21FN2O3
Molecular Weight344.39 g/mol
Exact Mass344.15
IUPAC Name1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide
SMILESCc1ccn(C2CC2)c(=O)c1C(=O)N(CCO)Cc1ccc(F)cc1
InChIInChI=1S/C19H21FN2O3/c1-13-8-9-22(16-6-7-16)19(25)17(13)18(24)21(10-11-23)12-14-2-4-15(20)5-3-14/h2-5,8-9,16,23H,6-7,10-12H2,1H3
InChIKeyCESLPSODELDPRB-UHFFFAOYSA-N
XLogP2.27
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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1-cyclopropyl-N-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N,4-dimethyl-2-oxopyridine-3-carboxamide
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N-benzyl-N-(3-hydroxypropyl)-4-methyl-2-oxo-1-(1-phenylethyl)pyridine-3-carboxamide
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N-ethyl-4-methyl-N-[(4-methylsulfanylphenyl)methyl]-2-oxo-1-(piperidin-3-ylmethyl)pyridine-3-carboxamide
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1-[(4-fluorophenyl)methyl]-1-(2-hydroxyethyl)-3-[2-[(2S)-oxan-2-yl]ethyl]urea
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CID 110190860
4-methyl-2-oxo-1-[1-(2-phenylethyl)piperidin-4-yl]pyridine-3-carboxylic acid
CID 170511544
4-bromo-1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-methylpyrrole-2-carboxamide
CID 60960256
N-ethyl-N-[(4-fluorophenyl)methyl]cyclopentanecarboxamide
CID 91410350
(6S)-6-benzyl-4-[1-(4-hydroxycyclohexyl)-4-methyl-2-oxopyridine-3-carbonyl]piperazin-2-one
CID 172660694
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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide (CID 172665801) is 1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide is Cc1ccn(C2CC2)c(=O)c1C(=O)N(CCO)Cc1ccc(F)cc1.
What is the InChIKey of 1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide?
The InChIKey is CESLPSODELDPRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O3/c1-13-8-9-22(16-6-7-16)19(25)17(13)18(24)21(10-11-23)12-14-2-4-15(20)5-3-14/h2-5,8-9,16,23H,6-7,10-12H2,1H3.
What are the key properties of 1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide?
1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide has a molecular weight of 344.39 g/mol, XLogP of 2.27, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(4-fluorophenyl)methyl]-N-(2-hydroxyethyl)-4-methyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 172665801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).