(2-methylcyclohexyl) N-cyclohexylcarbamate

C14H25NO2 — CID 5128034

IUPAC(2-methylcyclohexyl) N-cyclohexylcarbamate
SMILESCC1CCCCC1OC(=O)NC1CCCCC1
InChIInChI=1S/C14H25NO2/c1-11-7-5-6-10-13(11)17-14(16)15-12-8-3-2-4-9-12/h11-13H,2-10H2,1H3,(H,15,16)
InChIKeyDDSKHAHMBAVXFS-UHFFFAOYSA-N
MW239.36 g/mol
LogP3.62
Rot. Bonds2

About (2-methylcyclohexyl) N-cyclohexylcarbamate

(2-methylcyclohexyl) N-cyclohexylcarbamate (PubChem CID 5128034) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is (2-methylcyclohexyl) N-cyclohexylcarbamate.

Molecular Properties

Compound Name(2-methylcyclohexyl) N-cyclohexylcarbamate
PubChem CID5128034
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name(2-methylcyclohexyl) N-cyclohexylcarbamate
SMILESCC1CCCCC1OC(=O)NC1CCCCC1
InChIInChI=1S/C14H25NO2/c1-11-7-5-6-10-13(11)17-14(16)15-12-8-3-2-4-9-12/h11-13H,2-10H2,1H3,(H,15,16)
InChIKeyDDSKHAHMBAVXFS-UHFFFAOYSA-N
XLogP3.62
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclohexyl N-cyclohexylcarbamate
CID 3307288
5-Methyl-2-(propan-2-yl)cyclohexyl cyclohexylcarbamate
CID 22978781
4-cyclohexylbutyl N-cyclohexylcarbamate
CID 22978793
[(2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] N-cyclohexylcarbamate
CID 59044268
Cyclohexyl carbamate derivative 7
CID 46898982
tert-butyl N-((2-hydroxycyclohexyl)methyl)carbamate
CID 54595030
rac-tert-butyl N-[(1R,3R,4R)-4-hydroxy-3-methylcyclohexyl]carbamate
CID 69148227
2-propylpentyl N-cyclohexylcarbamate
CID 57342031
[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] N-cyclohexylcarbamate
CID 51682697
Carbonic acid, monoamide, N-hept-2-yl-, menthyl ester
CID 91698059
[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] N-(cyclohexylmethyl)carbamate
CID 58534580
heptyl N-{4-[(4-{[(heptyloxy)carbonyl]amino}cyclohexyl)methyl]cyclohexyl}carbamate
CID 3439383

Frequently Asked Questions

What is the IUPAC name of (2-methylcyclohexyl) N-cyclohexylcarbamate?
The IUPAC name of (2-methylcyclohexyl) N-cyclohexylcarbamate (CID 5128034) is (2-methylcyclohexyl) N-cyclohexylcarbamate.
What is the SMILES notation for (2-methylcyclohexyl) N-cyclohexylcarbamate?
The canonical SMILES for (2-methylcyclohexyl) N-cyclohexylcarbamate is CC1CCCCC1OC(=O)NC1CCCCC1.
What is the InChIKey of (2-methylcyclohexyl) N-cyclohexylcarbamate?
The InChIKey is DDSKHAHMBAVXFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-11-7-5-6-10-13(11)17-14(16)15-12-8-3-2-4-9-12/h11-13H,2-10H2,1H3,(H,15,16).
What are the key properties of (2-methylcyclohexyl) N-cyclohexylcarbamate?
(2-methylcyclohexyl) N-cyclohexylcarbamate has a molecular weight of 239.36 g/mol, XLogP of 3.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclohexyl) N-cyclohexylcarbamate is sourced from PubChem (CID 5128034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).