[4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea

C19H22N4O3 — CID 120733655

IUPAC[4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea
SMILESCOc1ccccc1C1CNCCN1C(=O)c1ccc(NC(N)=O)cc1
InChIInChI=1S/C19H22N4O3/c1-26-17-5-3-2-4-15(17)16-12-21-10-11-23(16)18(24)13-6-8-14(9-7-13)22-19(20)25/h2-9,16,21H,10-12H2,1H3,(H3,20,22,25)
InChIKeyJNAUEXYWNWDLFQ-UHFFFAOYSA-N
MW354.41 g/mol
LogP1.97
Rot. Bonds4

About [4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea

[4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea (PubChem CID 120733655) has the molecular formula C19H22N4O3 and a molecular weight of 354.41 g/mol. Its IUPAC name is [4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea.

Molecular Properties

Compound Name[4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea
PubChem CID120733655
Molecular FormulaC19H22N4O3
Molecular Weight354.41 g/mol
Exact Mass354.17
IUPAC Name[4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea
SMILESCOc1ccccc1C1CNCCN1C(=O)c1ccc(NC(N)=O)cc1
InChIInChI=1S/C19H22N4O3/c1-26-17-5-3-2-4-15(17)16-12-21-10-11-23(16)18(24)13-6-8-14(9-7-13)22-19(20)25/h2-9,16,21H,10-12H2,1H3,(H3,20,22,25)
InChIKeyJNAUEXYWNWDLFQ-UHFFFAOYSA-N
XLogP1.97
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 51.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze [4-[2-(2-methoxyphenyl)piperazine-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

(4-ethylphenyl)-[2-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 120733353
[2-(2-methoxyphenyl)piperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
CID 120734460
[2-(2-methoxyphenyl)piperazin-1-yl]-[4-(methylsulfanylmethyl)phenyl]methanone
CID 120734013
[2-(2-methoxyphenyl)piperazin-1-yl]-(3,4,5-trifluorophenyl)methanone
CID 120733240
N,N-diethyl-4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]benzamide;hydrochloride
CID 120733486
(3,4-diethoxyphenyl)-[2-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 120733355
[4-(cyclopropylmethoxy)phenyl]-[2-(2-methoxyphenyl)piperazin-1-yl]methanone;hydrochloride
CID 120733542
[2-(2-methoxyphenyl)piperazin-1-yl]-[4-(1,2,4-triazol-1-yl)phenyl]methanone
CID 120734009
[2-(2-methoxyphenyl)piperazin-1-yl]-pyridin-3-ylmethanone;dihydrochloride
CID 120732780
[2-(2-methoxyphenyl)piperazin-1-yl]-(3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanone;dihydrochloride
CID 120733748
(5-bromothiophen-3-yl)-[2-(2-methoxyphenyl)piperazin-1-yl]methanone;hydrochloride
CID 120734960
1-[5-[2-(2-methoxyphenyl)piperazine-1-carbonyl]-2,3-dihydroindol-1-yl]ethanone;hydrochloride
CID 120733724

Frequently Asked Questions

What is the IUPAC name of [4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea?
The IUPAC name of [4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea (CID 120733655) is [4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea.
What is the SMILES notation for [4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea?
The canonical SMILES for [4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea is COc1ccccc1C1CNCCN1C(=O)c1ccc(NC(N)=O)cc1.
What is the InChIKey of [4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea?
The InChIKey is JNAUEXYWNWDLFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O3/c1-26-17-5-3-2-4-15(17)16-12-21-10-11-23(16)18(24)13-6-8-14(9-7-13)22-19(20)25/h2-9,16,21H,10-12H2,1H3,(H3,20,22,25).
What are the key properties of [4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea?
[4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea has a molecular weight of 354.41 g/mol, XLogP of 1.97, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]urea is sourced from PubChem (CID 120733655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).