(4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate

C20H23NO3 — CID 54188372

IUPAC(4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate
SMILESCN(C(=O)Oc1ccc(Oc2ccccc2)cc1)C1CCCCC1
InChIInChI=1S/C20H23NO3/c1-21(16-8-4-2-5-9-16)20(22)24-19-14-12-18(13-15-19)23-17-10-6-3-7-11-17/h3,6-7,10-16H,2,4-5,8-9H2,1H3
InChIKeyPGSUZVFFYDPAOJ-UHFFFAOYSA-N
MW325.41 g/mol
LogP5.24
Rot. Bonds4

About (4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate

(4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate (PubChem CID 54188372) has the molecular formula C20H23NO3 and a molecular weight of 325.41 g/mol. Its IUPAC name is (4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate.

Molecular Properties

Compound Name(4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate
PubChem CID54188372
Molecular FormulaC20H23NO3
Molecular Weight325.41 g/mol
Exact Mass325.17
IUPAC Name(4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate
SMILESCN(C(=O)Oc1ccc(Oc2ccccc2)cc1)C1CCCCC1
InChIInChI=1S/C20H23NO3/c1-21(16-8-4-2-5-9-16)20(22)24-19-14-12-18(13-15-19)23-17-10-6-3-7-11-17/h3,6-7,10-16H,2,4-5,8-9H2,1H3
InChIKeyPGSUZVFFYDPAOJ-UHFFFAOYSA-N
XLogP5.24
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.41
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(2S)-1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl] 4-phenoxybenzoate
CID 7859663
[4-[acetyl(cyclohexyl)amino]phenyl] N-methyl-N-phenylcarbamate
CID 91520177
(3-hydroxy-3H-inden-1-yl) N-cyclohexyl-N-methylcarbamate
CID 67985719
1-cyclohexyloxy-4-phenoxybenzene
CID 70600234
[3-(2-methylpropoxycarbonylamino)phenyl] N-cyclohexyl-N-methylcarbamate
CID 70477318
[3-[(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propyl]phenyl] N-cyclohexyl-N-methylcarbamate
CID 11825637
[3-[2-[methyl(prop-2-ynyl)amino]propyl]phenyl] N-cyclohexyl-N-methylcarbamate
CID 11188132
[3-[2-(prop-2-ynylamino)propyl]phenyl] N-cyclohexyl-N-methylcarbamate
CID 11068527
2-[cyclohexyl(methyl)amino]-N-(2-phenoxyphenyl)acetamide
CID 46800677
phenyl N-(1-cyclopropylethyl)-N-methylcarbamate
CID 60724808
3-(2-amino-6-phenoxy-3,4-dihydroquinolin-3-yl)-N-cyclohexyl-N-methylpropanamide
CID 59428164
hydron;phenyl cycloheptanecarboxylate
CID 174768034

Frequently Asked Questions

What is the IUPAC name of (4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate?
The IUPAC name of (4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate (CID 54188372) is (4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate.
What is the SMILES notation for (4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate?
The canonical SMILES for (4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate is CN(C(=O)Oc1ccc(Oc2ccccc2)cc1)C1CCCCC1.
What is the InChIKey of (4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate?
The InChIKey is PGSUZVFFYDPAOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO3/c1-21(16-8-4-2-5-9-16)20(22)24-19-14-12-18(13-15-19)23-17-10-6-3-7-11-17/h3,6-7,10-16H,2,4-5,8-9H2,1H3.
What are the key properties of (4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate?
(4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate has a molecular weight of 325.41 g/mol, XLogP of 5.24, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-phenoxyphenyl) N-cyclohexyl-N-methylcarbamate is sourced from PubChem (CID 54188372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).