[3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate

C19H20FNO2 — CID 11174440

IUPAC[3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate
SMILESO=C(NC1CCCCC1)Oc1cccc(-c2cccc(F)c2)c1
InChIInChI=1S/C19H20FNO2/c20-16-8-4-6-14(12-16)15-7-5-11-18(13-15)23-19(22)21-17-9-2-1-3-10-17/h4-8,11-13,17H,1-3,9-10H2,(H,21,22)
InChIKeyMCNDXCUHXOOQMA-UHFFFAOYSA-N
MW313.37 g/mol
LogP4.91
Rot. Bonds3

About [3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate

[3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate (PubChem CID 11174440) has the molecular formula C19H20FNO2 and a molecular weight of 313.37 g/mol. Its IUPAC name is [3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate.

Molecular Properties

Compound Name[3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate
PubChem CID11174440
Molecular FormulaC19H20FNO2
Molecular Weight313.37 g/mol
Exact Mass313.15
IUPAC Name[3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate
SMILESO=C(NC1CCCCC1)Oc1cccc(-c2cccc(F)c2)c1
InChIInChI=1S/C19H20FNO2/c20-16-8-4-6-14(12-16)15-7-5-11-18(13-15)23-19(22)21-17-9-2-1-3-10-17/h4-8,11-13,17H,1-3,9-10H2,(H,21,22)
InChIKeyMCNDXCUHXOOQMA-UHFFFAOYSA-N
XLogP4.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.37
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(3-fluoro-4-{3-[(hexylcarbamoyl)oxy]phenyl}phenyl)propanoic acid
CID 117072556
Cyclohexylcarbamic acid biphenyl-3-yl ester
CID 10108554
6-Hydroxy-[1,1'-biphenyl]-3-yl cyclohexylcarbamate
CID 44626363
FAAH/COX inhibitor ARN2508
CID 72792469
3-Tert-butylphenyl sec-butylcarbamate
CID 124542
3-[2-(prop-2-yn-1-ylamino)propyl]phenyl N-cyclohexyl-N-methylcarbamate
CID 11068527
Cyclopentylcarbamic Acid Biphenyl-3-yl Ester
CID 24881674
(2R)-2-(3-fluoro-4-{3-[(hexylcarbamoyl)oxy]phenyl}phenyl)propanoic acid
CID 117072557
6-Methyl[1,1'-biphenyl]-3-yl cyclohexylcarbamate
CID 58801126
FAAH Inhibitor, 2h
CID 71699784
benzyl N-(5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)carbamate
CID 54762648
4-methoxyphenyl N-phenethylcarbamate
CID 2802350

Frequently Asked Questions

What is the IUPAC name of [3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate?
The IUPAC name of [3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate (CID 11174440) is [3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate.
What is the SMILES notation for [3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate?
The canonical SMILES for [3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate is O=C(NC1CCCCC1)Oc1cccc(-c2cccc(F)c2)c1.
What is the InChIKey of [3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate?
The InChIKey is MCNDXCUHXOOQMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO2/c20-16-8-4-6-14(12-16)15-7-5-11-18(13-15)23-19(22)21-17-9-2-1-3-10-17/h4-8,11-13,17H,1-3,9-10H2,(H,21,22).
What are the key properties of [3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate?
[3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate has a molecular weight of 313.37 g/mol, XLogP of 4.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-fluorophenyl)phenyl] N-cyclohexylcarbamate is sourced from PubChem (CID 11174440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).