N-methyl-N-(phenylcarbamoyl)carbamate

C9H9N2O3- — CID 22769928

IUPACN-methyl-N-(phenylcarbamoyl)carbamate
SMILESCN(C(=O)[O-])C(=O)Nc1ccccc1
InChIInChI=1S/C9H10N2O3/c1-11(9(13)14)8(12)10-7-5-3-2-4-6-7/h2-6H,1H3,(H,10,12)(H,13,14)/p-1
InChIKeyWBKROJZXIZXYAQ-UHFFFAOYSA-M
MW193.18 g/mol
LogP0.49
Rot. Bonds1

About N-methyl-N-(phenylcarbamoyl)carbamate

N-methyl-N-(phenylcarbamoyl)carbamate (PubChem CID 22769928) has the molecular formula C9H9N2O3- and a molecular weight of 193.18 g/mol. Its IUPAC name is N-methyl-N-(phenylcarbamoyl)carbamate.

Molecular Properties

Compound NameN-methyl-N-(phenylcarbamoyl)carbamate
PubChem CID22769928
Molecular FormulaC9H9N2O3-
Molecular Weight193.18 g/mol
Exact Mass193.06
IUPAC NameN-methyl-N-(phenylcarbamoyl)carbamate
SMILESCN(C(=O)[O-])C(=O)Nc1ccccc1
InChIInChI=1S/C9H10N2O3/c1-11(9(13)14)8(12)10-7-5-3-2-4-6-7/h2-6H,1H3,(H,10,12)(H,13,14)/p-1
InChIKeyWBKROJZXIZXYAQ-UHFFFAOYSA-M
XLogP0.49
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.18
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(ethylcarbamoyl)-1-methyl-3-phenylurea
CID 12876426
N'-methyl-N-phenyl-N'-(phenylcarbamoyl)propanediamide
CID 12864691
1-chloro-1-methyl-3-phenylurea
CID 173170547
1,1-bis(methylamino)-3-phenylurea
CID 54267679
(2S)-2-[methyl(phenylcarbamoyl)amino]propanoic acid
CID 71355606
N-methyl-N-(phenylcarbamoyl)morpholine-4-carboxamide
CID 12876147
potassium 2-anilino-2-oxoacetate
CID 23690423
1-methyl-1-(4-methylphenyl)sulfonyl-3-phenylurea
CID 15716439
3-(4-aminophenyl)-1-methyl-1-phenylurea
CID 43468906
1-[benzyl(methyl)amino]-1-methyl-3-phenylurea
CID 70294389
1-amino-3-phenyl-1-propan-2-ylurea
CID 174763557
cobalt;N-phenylacetamide
CID 158689050

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(phenylcarbamoyl)carbamate?
The IUPAC name of N-methyl-N-(phenylcarbamoyl)carbamate (CID 22769928) is N-methyl-N-(phenylcarbamoyl)carbamate.
What is the SMILES notation for N-methyl-N-(phenylcarbamoyl)carbamate?
The canonical SMILES for N-methyl-N-(phenylcarbamoyl)carbamate is CN(C(=O)[O-])C(=O)Nc1ccccc1.
What is the InChIKey of N-methyl-N-(phenylcarbamoyl)carbamate?
The InChIKey is WBKROJZXIZXYAQ-UHFFFAOYSA-M. The full InChI is InChI=1S/C9H10N2O3/c1-11(9(13)14)8(12)10-7-5-3-2-4-6-7/h2-6H,1H3,(H,10,12)(H,13,14)/p-1.
What are the key properties of N-methyl-N-(phenylcarbamoyl)carbamate?
N-methyl-N-(phenylcarbamoyl)carbamate has a molecular weight of 193.18 g/mol, XLogP of 0.49, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(phenylcarbamoyl)carbamate is sourced from PubChem (CID 22769928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).