chloro N-cyclopropyl-N-phenylcarbamate

C10H10ClNO2 — CID 174185498

IUPACchloro N-cyclopropyl-N-phenylcarbamate
SMILESO=C(OCl)N(c1ccccc1)C1CC1
InChIInChI=1S/C10H10ClNO2/c11-14-10(13)12(9-6-7-9)8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChIKeyURWSVRGKJSXNMH-UHFFFAOYSA-N
MW211.65 g/mol
LogP2.95
Rot. Bonds2

About chloro N-cyclopropyl-N-phenylcarbamate

chloro N-cyclopropyl-N-phenylcarbamate (PubChem CID 174185498) has the molecular formula C10H10ClNO2 and a molecular weight of 211.65 g/mol. Its IUPAC name is chloro N-cyclopropyl-N-phenylcarbamate.

Molecular Properties

Compound Namechloro N-cyclopropyl-N-phenylcarbamate
PubChem CID174185498
Molecular FormulaC10H10ClNO2
Molecular Weight211.65 g/mol
Exact Mass211.04
IUPAC Namechloro N-cyclopropyl-N-phenylcarbamate
SMILESO=C(OCl)N(c1ccccc1)C1CC1
InChIInChI=1S/C10H10ClNO2/c11-14-10(13)12(9-6-7-9)8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChIKeyURWSVRGKJSXNMH-UHFFFAOYSA-N
XLogP2.95
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.65
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

benzyl N-(4-methylcyclohexyl)-N-phenylcarbamate
CID 71093991
N-cyclohexyl-N-phenylcarbamoyl chloride
CID 18329458
phenyl N-[4-(aminomethyl)phenyl]-N-cyclopropylcarbamate
CID 43276104
tert-butyl N-phenyl-N-[(3S)-pyrrolidin-3-yl]carbamate
CID 129353875
N-cyclopropyl-N-phenylpyridine-2-carboxamide
CID 68859541
N-(1-methylpiperidin-4-yl)-N-phenylacetamide
CID 527022
(2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide
CID 97357253
(2-bromophenyl)-cyclopropylcarbamic acid
CID 174207463
tert-butyl N-(azepan-3-yl)-N-phenylcarbamate
CID 141141954
N-cyclohexyl-2-[2-[2-(N-cyclohexylanilino)-2-oxoethoxy]phenoxy]-N-phenylacetamide
CID 102017753
cyclopropyl-(4-phenylmethoxyphenyl)carbamic acid
CID 67143911
methyl N-(4-acetamidophenyl)-N-cyclopropylcarbamate
CID 113095123

Frequently Asked Questions

What is the IUPAC name of chloro N-cyclopropyl-N-phenylcarbamate?
The IUPAC name of chloro N-cyclopropyl-N-phenylcarbamate (CID 174185498) is chloro N-cyclopropyl-N-phenylcarbamate.
What is the SMILES notation for chloro N-cyclopropyl-N-phenylcarbamate?
The canonical SMILES for chloro N-cyclopropyl-N-phenylcarbamate is O=C(OCl)N(c1ccccc1)C1CC1.
What is the InChIKey of chloro N-cyclopropyl-N-phenylcarbamate?
The InChIKey is URWSVRGKJSXNMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClNO2/c11-14-10(13)12(9-6-7-9)8-4-2-1-3-5-8/h1-5,9H,6-7H2.
What are the key properties of chloro N-cyclopropyl-N-phenylcarbamate?
chloro N-cyclopropyl-N-phenylcarbamate has a molecular weight of 211.65 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro N-cyclopropyl-N-phenylcarbamate is sourced from PubChem (CID 174185498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).