(4-benzylphenyl) carbamate

C14H13NO2 — CID 7572

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IUPAC(4-benzylphenyl) carbamate
SMILESNC(=O)Oc1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C14H13NO2/c15-14(16)17-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,15,16)
InChIKeyZBJBRUSGEJORQL-UHFFFAOYSA-N
MW227.26 g/mol
LogP2.73
Rot. Bonds3

About (4-benzylphenyl) carbamate

(4-benzylphenyl) carbamate (PubChem CID 7572) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is (4-benzylphenyl) carbamate.

Molecular Properties

Compound Name(4-benzylphenyl) carbamate
PubChem CID7572
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC Name(4-benzylphenyl) carbamate
SMILESNC(=O)Oc1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C14H13NO2/c15-14(16)17-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,15,16)
InChIKeyZBJBRUSGEJORQL-UHFFFAOYSA-N
XLogP2.73
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Isoprocarb
CID 17517
4-Methoxydiphenylmethane
CID 13264
1,1'-Biphenyl, 4,4'-dimethoxy-
CID 16484
Dienestrol diacetate
CID 5805243
4,4'-Dimethoxybibenzyl
CID 74261
4-Acetoxybiphenyl
CID 346066
4,4'-Ethylidenediphenyl dicyanate
CID 93247
1,1'-Methylenebis(4-methoxybenzene)
CID 219137
1,1-Bis(4-methoxyphenyl)ethylene
CID 316724
Di-p-tolyl carbonate
CID 221530
3,4-Bis(4-acetoxyphenyl)-2,4-hexadiene
CID 6767
Paxamate
CID 71210

Frequently Asked Questions

What is the IUPAC name of (4-benzylphenyl) carbamate?
The IUPAC name of (4-benzylphenyl) carbamate (CID 7572) is (4-benzylphenyl) carbamate.
What is the SMILES notation for (4-benzylphenyl) carbamate?
The canonical SMILES for (4-benzylphenyl) carbamate is NC(=O)Oc1ccc(Cc2ccccc2)cc1.
What is the InChIKey of (4-benzylphenyl) carbamate?
The InChIKey is ZBJBRUSGEJORQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c15-14(16)17-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,15,16).
What are the key properties of (4-benzylphenyl) carbamate?
(4-benzylphenyl) carbamate has a molecular weight of 227.26 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-benzylphenyl) carbamate is sourced from PubChem (CID 7572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).