cyclobutyl N-(3-phenylphenyl)carbamate

C17H17NO2 — CID 57392118

IUPACcyclobutyl N-(3-phenylphenyl)carbamate
SMILESO=C(Nc1cccc(-c2ccccc2)c1)OC1CCC1
InChIInChI=1S/C17H17NO2/c19-17(20-16-10-5-11-16)18-15-9-4-8-14(12-15)13-6-2-1-3-7-13/h1-4,6-9,12,16H,5,10-11H2,(H,18,19)
InChIKeyINDCUJCNCZVEBC-UHFFFAOYSA-N
MW267.33 g/mol
LogP4.45
Rot. Bonds3

About cyclobutyl N-(3-phenylphenyl)carbamate

cyclobutyl N-(3-phenylphenyl)carbamate (PubChem CID 57392118) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is cyclobutyl N-(3-phenylphenyl)carbamate.

Molecular Properties

Compound Namecyclobutyl N-(3-phenylphenyl)carbamate
PubChem CID57392118
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Namecyclobutyl N-(3-phenylphenyl)carbamate
SMILESO=C(Nc1cccc(-c2ccccc2)c1)OC1CCC1
InChIInChI=1S/C17H17NO2/c19-17(20-16-10-5-11-16)18-15-9-4-8-14(12-15)13-6-2-1-3-7-13/h1-4,6-9,12,16H,5,10-11H2,(H,18,19)
InChIKeyINDCUJCNCZVEBC-UHFFFAOYSA-N
XLogP4.45
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Urb602
CID 10979337
Dimethyl 4',4''-methylenedicarbanilate
CID 99337
Phenethyl phenylcarbamate
CID 347208
Carbanilic acid, p-methyl-, isopropyl ester
CID 37489
C,C'-Diethyl N,N'-(methylenedi-4,1-phenylene)bis(carbamate)
CID 82348
Carbanilic acid, o-methyl-, isopropyl ester
CID 38011
Biphenyl-2-ylcarbamic Acid Piperidin-4-yl Ester
CID 10851461
1-Propylpiperidin-4-yl biphenyl-2-ylcarbamate
CID 53317169
1-Methylpiperidin-4-yl [1,1'-biphenyl]-2-ylcarbamate
CID 53318454
1-Butylpiperidin-4-yl biphenyl-2-ylcarbamate
CID 53321084
1-Ethylpiperidin-4-yl biphenyl-2-ylcarbamate
CID 53326338
3-Phenylpropyl phenylcarbamate
CID 2254838

Frequently Asked Questions

What is the IUPAC name of cyclobutyl N-(3-phenylphenyl)carbamate?
The IUPAC name of cyclobutyl N-(3-phenylphenyl)carbamate (CID 57392118) is cyclobutyl N-(3-phenylphenyl)carbamate.
What is the SMILES notation for cyclobutyl N-(3-phenylphenyl)carbamate?
The canonical SMILES for cyclobutyl N-(3-phenylphenyl)carbamate is O=C(Nc1cccc(-c2ccccc2)c1)OC1CCC1.
What is the InChIKey of cyclobutyl N-(3-phenylphenyl)carbamate?
The InChIKey is INDCUJCNCZVEBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c19-17(20-16-10-5-11-16)18-15-9-4-8-14(12-15)13-6-2-1-3-7-13/h1-4,6-9,12,16H,5,10-11H2,(H,18,19).
What are the key properties of cyclobutyl N-(3-phenylphenyl)carbamate?
cyclobutyl N-(3-phenylphenyl)carbamate has a molecular weight of 267.33 g/mol, XLogP of 4.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl N-(3-phenylphenyl)carbamate is sourced from PubChem (CID 57392118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).