1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea

C20H23N3O3 — CID 99129473

IUPAC1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea
SMILESCOc1cccc(NC(=O)Nc2ccccc2C(=O)N2CCCCC2)c1
InChIInChI=1S/C20H23N3O3/c1-26-16-9-7-8-15(14-16)21-20(25)22-18-11-4-3-10-17(18)19(24)23-12-5-2-6-13-23/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H2,21,22,25)
InChIKeyDSTLWPGTICUAJD-UHFFFAOYSA-N
MW353.42 g/mol
LogP3.97
Rot. Bonds4

About 1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea

1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea (PubChem CID 99129473) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea
PubChem CID99129473
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea
SMILESCOc1cccc(NC(=O)Nc2ccccc2C(=O)N2CCCCC2)c1
InChIInChI=1S/C20H23N3O3/c1-26-16-9-7-8-15(14-16)21-20(25)22-18-11-4-3-10-17(18)19(24)23-12-5-2-6-13-23/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H2,21,22,25)
InChIKeyDSTLWPGTICUAJD-UHFFFAOYSA-N
XLogP3.97
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]propanamide
CID 28637146
2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide
CID 46764443
(2S)-N-[2-(azepane-1-carbonyl)phenyl]-2-(3-methoxyphenoxy)butanamide
CID 28632970
3-(3-methoxyphenyl)-N-[2-(piperidine-1-carbonyl)phenyl]propanamide
CID 35279052
2-chloro-N-[3-[(3-methoxyphenyl)carbamoylamino]-4-piperidin-1-ylphenyl]benzamide
CID 46326591
methyl N-[2-(pyrrolidine-1-carbonyl)phenyl]carbamate
CID 551078
1-(2,4-dimethoxyphenyl)-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(piperidine-1-carbonyl)phenyl]urea
CID 1064665
(3-aminopiperidin-1-yl)-[2-(3-methoxyanilino)phenyl]methanone
CID 119377562
1-(2,4-dihydroxyphenyl)-3-(3-methoxyphenyl)urea
CID 69014425
phenyl N-[2-(piperidine-1-carbonyl)phenyl]carbamate
CID 5064949
1-(3-methoxyphenyl)-3-(2-morpholin-4-ylphenyl)urea
CID 108869153
[5-amino-2-(3-methoxyanilino)phenyl]-pyrrolidin-1-ylmethanone
CID 100648504

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea?
The IUPAC name of 1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea (CID 99129473) is 1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea.
What is the SMILES notation for 1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea?
The canonical SMILES for 1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea is COc1cccc(NC(=O)Nc2ccccc2C(=O)N2CCCCC2)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea?
The InChIKey is DSTLWPGTICUAJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-26-16-9-7-8-15(14-16)21-20(25)22-18-11-4-3-10-17(18)19(24)23-12-5-2-6-13-23/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H2,21,22,25).
What are the key properties of 1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea?
1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea has a molecular weight of 353.42 g/mol, XLogP of 3.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea is sourced from PubChem (CID 99129473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).