1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea

C20H18ClN3O2 — CID 52941873

IUPAC1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)Nc1cccn(Cc2ccccc2Cl)c1=O
InChIInChI=1S/C20H18ClN3O2/c1-14-7-2-5-10-17(14)22-20(26)23-18-11-6-12-24(19(18)25)13-15-8-3-4-9-16(15)21/h2-12H,13H2,1H3,(H2,22,23,26)
InChIKeyCLQNWHYSPRXVOG-UHFFFAOYSA-N
MW367.84 g/mol
LogP4.50
Rot. Bonds4

About 1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea

1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea (PubChem CID 52941873) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is 1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea.

Molecular Properties

Compound Name1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea
PubChem CID52941873
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC Name1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)Nc1cccn(Cc2ccccc2Cl)c1=O
InChIInChI=1S/C20H18ClN3O2/c1-14-7-2-5-10-17(14)22-20(26)23-18-11-6-12-24(19(18)25)13-15-8-3-4-9-16(15)21/h2-12H,13H2,1H3,(H2,22,23,26)
InChIKeyCLQNWHYSPRXVOG-UHFFFAOYSA-N
XLogP4.50
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.84
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

L 735821
CID 5282279
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CID 9980155
N-(2-(3-((2S,5R)-4-(4-fluorobenzyl)-2,5-dimethylpiperazin-1-yl)-3-oxoprop-1-enyl)-5-chlorophenyl)acetamide
CID 10003548
N-(2-(3-((2R,5S)-4-(4-fluorobenzyl)-2,5-dimethylpiperazin-1-yl)-3-oxoprop-1-enyl)-5-chlorophenyl)acetamide
CID 10456104
N-[5-Chloro-2-[(1E)-3-[(2R)-4-[(4-fluorophenyl)methyl]-2-methyl-1-piperazinyl]-3-oxo-1-propen-1-YL]phenyl]-acetamide
CID 11743399
2-(4-Benzyl-1-piperazinyl)-N-(3-chloro-4-methylphenyl)acetamide
CID 1206470
3-(3-Chloro-4-methylphenyl)-1,1-dibenzylurea
CID 3498635
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CID 23645834
2-{[(2-chlorophenyl)methyl][(2,4-difluorophenyl)carbamoyl]amino}-N-hydroxypropanamide
CID 23645837
6-[4-(3,5-dichloro-4-methylphenyl)piperazine-1-carbonyl]pyrimidine-2,4(1H,3H)-dione
CID 156905881
(2S)-2-[(4-chloro-2-methylphenyl)carbamoylamino]-N-[(E,3S)-6-oxo-1-phenylhept-4-en-3-yl]-3-phenylpropanamide
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Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea?
The IUPAC name of 1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea (CID 52941873) is 1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea.
What is the SMILES notation for 1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea?
The canonical SMILES for 1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea is Cc1ccccc1NC(=O)Nc1cccn(Cc2ccccc2Cl)c1=O.
What is the InChIKey of 1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea?
The InChIKey is CLQNWHYSPRXVOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-14-7-2-5-10-17(14)22-20(26)23-18-11-6-12-24(19(18)25)13-15-8-3-4-9-16(15)21/h2-12H,13H2,1H3,(H2,22,23,26).
What are the key properties of 1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea?
1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea has a molecular weight of 367.84 g/mol, XLogP of 4.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-(2-methylphenyl)urea is sourced from PubChem (CID 52941873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).