methyl N-(phenylcarbamoyl)carbamate

C9H10N2O3 — CID 13097714

IUPACmethyl N-(phenylcarbamoyl)carbamate
SMILESCOC(=O)NC(=O)Nc1ccccc1
InChIInChI=1S/C9H10N2O3/c1-14-9(13)11-8(12)10-7-5-3-2-4-6-7/h2-6H,1H3,(H2,10,11,12,13)
InChIKeyJGMYNYMOKQEUGY-UHFFFAOYSA-N
MW194.19 g/mol
LogP1.57
Rot. Bonds1

About methyl N-(phenylcarbamoyl)carbamate

methyl N-(phenylcarbamoyl)carbamate (PubChem CID 13097714) has the molecular formula C9H10N2O3 and a molecular weight of 194.19 g/mol. Its IUPAC name is methyl N-(phenylcarbamoyl)carbamate.

Molecular Properties

Compound Namemethyl N-(phenylcarbamoyl)carbamate
PubChem CID13097714
Molecular FormulaC9H10N2O3
Molecular Weight194.19 g/mol
Exact Mass194.07
IUPAC Namemethyl N-(phenylcarbamoyl)carbamate
SMILESCOC(=O)NC(=O)Nc1ccccc1
InChIInChI=1S/C9H10N2O3/c1-14-9(13)11-8(12)10-7-5-3-2-4-6-7/h2-6H,1H3,(H2,10,11,12,13)
InChIKeyJGMYNYMOKQEUGY-UHFFFAOYSA-N
XLogP1.57
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze methyl N-(phenylcarbamoyl)carbamate 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

CID 68594224
CID 68594224
butyl N-(phenylcarbamoyl)carbamate
CID 67363969
3-oxo-N-(phenylcarbamoyl)butanamide
CID 10466039
1,1-diphenyl-3-(phenylcarbamoyl)urea
CID 71359478
2-chloro-N-(phenylcarbamoyl)acetamide
CID 10976790
ethyl carbamate;methyl N-[[2-(methoxycarbonylcarbamoylamino)phenyl]carbamoyl]carbamate
CID 67206076
1-methyl-3-phenylurea;propane
CID 142949663
N-methoxy-4-(phenylcarbamoylamino)benzamide
CID 33101054
cobalt;N-phenylacetamide
CID 158689050
tert-butyl N-[1-(phenylcarbamoylcarbamoyl)cyclobutyl]carbamate
CID 70294522
1-carbamoyl-3-(phenylcarbamoyl)urea;diethyl carbonate
CID 161323635
2-methyl-3-phenyl-N-(phenylcarbamoyl)prop-2-enamide
CID 4153463

Frequently Asked Questions

What is the IUPAC name of methyl N-(phenylcarbamoyl)carbamate?
The IUPAC name of methyl N-(phenylcarbamoyl)carbamate (CID 13097714) is methyl N-(phenylcarbamoyl)carbamate.
What is the SMILES notation for methyl N-(phenylcarbamoyl)carbamate?
The canonical SMILES for methyl N-(phenylcarbamoyl)carbamate is COC(=O)NC(=O)Nc1ccccc1.
What is the InChIKey of methyl N-(phenylcarbamoyl)carbamate?
The InChIKey is JGMYNYMOKQEUGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3/c1-14-9(13)11-8(12)10-7-5-3-2-4-6-7/h2-6H,1H3,(H2,10,11,12,13).
What are the key properties of methyl N-(phenylcarbamoyl)carbamate?
methyl N-(phenylcarbamoyl)carbamate has a molecular weight of 194.19 g/mol, XLogP of 1.57, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(phenylcarbamoyl)carbamate is sourced from PubChem (CID 13097714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).