[3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate

C15H14ClN3O3 — CID 134123011

IUPAC[3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate
SMILESCNC(=O)Oc1cccc(NC(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C15H14ClN3O3/c1-17-15(21)22-11-6-4-5-10(9-11)18-14(20)19-13-8-3-2-7-12(13)16/h2-9H,1H3,(H,17,21)(H2,18,19,20)
InChIKeySEZATXZHYXTMCE-UHFFFAOYSA-N
MW319.75 g/mol
LogP3.70
Rot. Bonds3

About [3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate

[3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate (PubChem CID 134123011) has the molecular formula C15H14ClN3O3 and a molecular weight of 319.75 g/mol. Its IUPAC name is [3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate.

Molecular Properties

Compound Name[3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate
PubChem CID134123011
Molecular FormulaC15H14ClN3O3
Molecular Weight319.75 g/mol
Exact Mass319.07
IUPAC Name[3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate
SMILESCNC(=O)Oc1cccc(NC(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C15H14ClN3O3/c1-17-15(21)22-11-6-4-5-10(9-11)18-14(20)19-13-8-3-2-7-12(13)16/h2-9H,1H3,(H,17,21)(H2,18,19,20)
InChIKeySEZATXZHYXTMCE-UHFFFAOYSA-N
XLogP3.70
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.75
LogP ≤ 53.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze [3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate 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

[3-(methylcarbamoylamino)phenyl] N-(2,6-dichlorophenyl)carbamate
CID 134094489
[3-(phenoxycarbonylamino)phenyl] N-methylcarbamate
CID 134105214
methyl 3-[(2-chlorophenyl)carbamoylamino]benzoate
CID 43404884
1-(3-bromophenyl)-3-(2-chlorophenyl)urea
CID 43398005
N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide
CID 45000733
[3-[(2-hydroxyphenyl)carbamoylamino]phenyl] acetate
CID 108865153
1-(2-bromo-3-chlorophenyl)-3-(3-methoxyphenyl)urea
CID 103480109
[3-[[(E)-2-methylbut-2-enoyl]amino]phenyl] N-methylcarbamate
CID 6070588
[3-[(2-bromophenyl)carbamoylamino]phenyl] acetate
CID 108865321
1-[3-(aminomethyl)phenyl]-3-(2-chlorophenyl)urea
CID 63254522
[3-(methylcarbamoylamino)phenyl] N-(4-methylphenyl)carbamate
CID 134123027
[3-[[2-(trifluoromethyl)phenyl]carbamoylamino]phenyl] acetate
CID 108865068

Frequently Asked Questions

What is the IUPAC name of [3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate?
The IUPAC name of [3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate (CID 134123011) is [3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate.
What is the SMILES notation for [3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate?
The canonical SMILES for [3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate is CNC(=O)Oc1cccc(NC(=O)Nc2ccccc2Cl)c1.
What is the InChIKey of [3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate?
The InChIKey is SEZATXZHYXTMCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3O3/c1-17-15(21)22-11-6-4-5-10(9-11)18-14(20)19-13-8-3-2-7-12(13)16/h2-9H,1H3,(H,17,21)(H2,18,19,20).
What are the key properties of [3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate?
[3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate has a molecular weight of 319.75 g/mol, XLogP of 3.70, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(2-chlorophenyl)carbamoylamino]phenyl] N-methylcarbamate is sourced from PubChem (CID 134123011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).