ethyl N-(4-propylcyclohexyl)carbamate

C12H23NO2 — CID 61381222

IUPACethyl N-(4-propylcyclohexyl)carbamate
SMILESCCCC1CCC(NC(=O)OCC)CC1
InChIInChI=1S/C12H23NO2/c1-3-5-10-6-8-11(9-7-10)13-12(14)15-4-2/h10-11H,3-9H2,1-2H3,(H,13,14)
InChIKeyHNEHZWFUUCVEBA-UHFFFAOYSA-N
MW213.32 g/mol
LogP3.09
Rot. Bonds4

About ethyl N-(4-propylcyclohexyl)carbamate

ethyl N-(4-propylcyclohexyl)carbamate (PubChem CID 61381222) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is ethyl N-(4-propylcyclohexyl)carbamate.

Molecular Properties

Compound Nameethyl N-(4-propylcyclohexyl)carbamate
PubChem CID61381222
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Nameethyl N-(4-propylcyclohexyl)carbamate
SMILESCCCC1CCC(NC(=O)OCC)CC1
InChIInChI=1S/C12H23NO2/c1-3-5-10-6-8-11(9-7-10)13-12(14)15-4-2/h10-11H,3-9H2,1-2H3,(H,13,14)
InChIKeyHNEHZWFUUCVEBA-UHFFFAOYSA-N
XLogP3.09
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze ethyl N-(4-propylcyclohexyl)carbamate 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

ethyl N-(4-butylcyclohexyl)carbamate
CID 145473547
2-hydroxyethyl N-(4-propylcyclohexyl)carbamate
CID 79349163
ethyl 2-oxo-2-[(4-propylcyclohexyl)amino]acetate
CID 54963755
ethyl N-[4-(methylamino)cyclohexyl]carbamate
CID 43653652
benzyl N-(4-propylcyclohexyl)carbamate
CID 130580975
ethyl N-(thian-4-yl)carbamate
CID 115599837
ethyl N-(4-oxocyclohexyl)carbamate
CID 12546192
ethyl N-(1-methylpiperidin-4-yl)carbamate
CID 58960911
2-hydroxy-2-methyl-N-(4-propylcyclohexyl)propanamide
CID 103429701
[4-(propoxycarbonylamino)cyclohexyl]carbamic acid
CID 139823141
ethyl N-(1-cyclopentyl-5-propylpiperidin-3-yl)carbamate
CID 112543963
ethyl N-(1,5-dipropylpiperidin-3-yl)carbamate
CID 112543689

Frequently Asked Questions

What is the IUPAC name of ethyl N-(4-propylcyclohexyl)carbamate?
The IUPAC name of ethyl N-(4-propylcyclohexyl)carbamate (CID 61381222) is ethyl N-(4-propylcyclohexyl)carbamate.
What is the SMILES notation for ethyl N-(4-propylcyclohexyl)carbamate?
The canonical SMILES for ethyl N-(4-propylcyclohexyl)carbamate is CCCC1CCC(NC(=O)OCC)CC1.
What is the InChIKey of ethyl N-(4-propylcyclohexyl)carbamate?
The InChIKey is HNEHZWFUUCVEBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-3-5-10-6-8-11(9-7-10)13-12(14)15-4-2/h10-11H,3-9H2,1-2H3,(H,13,14).
What are the key properties of ethyl N-(4-propylcyclohexyl)carbamate?
ethyl N-(4-propylcyclohexyl)carbamate has a molecular weight of 213.32 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(4-propylcyclohexyl)carbamate is sourced from PubChem (CID 61381222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).