propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate

C11H21NO2 — CID 116656090

IUPACpropan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate
SMILESCC(C)OC(=O)NCC1(C)CCCC1
InChIInChI=1S/C11H21NO2/c1-9(2)14-10(13)12-8-11(3)6-4-5-7-11/h9H,4-8H2,1-3H3,(H,12,13)
InChIKeySJJUXPUGHFUDGA-UHFFFAOYSA-N
MW199.29 g/mol
LogP2.70
Rot. Bonds3

About propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate

propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate (PubChem CID 116656090) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate.

Molecular Properties

Compound Namepropan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate
PubChem CID116656090
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Namepropan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate
SMILESCC(C)OC(=O)NCC1(C)CCCC1
InChIInChI=1S/C11H21NO2/c1-9(2)14-10(13)12-8-11(3)6-4-5-7-11/h9H,4-8H2,1-3H3,(H,12,13)
InChIKeySJJUXPUGHFUDGA-UHFFFAOYSA-N
XLogP2.70
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze propan-2-yl N-[(1-methylcyclopentyl)methyl]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

(2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
CID 103798136
2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
CID 103798125
propan-2-yl N-[(1-formylcyclopropyl)methyl]carbamate
CID 123801735
N-[(1-methylcycloheptyl)methyl]acetamide
CID 127751208
3-amino-2-methyl-N-[(1-methylcyclohexyl)methyl]butanamide
CID 103581061
2-methyl-N-[(1-methylcyclobutyl)methyl]propanamide
CID 103737357
propan-2-yl N-[(4-hydroxyoxan-4-yl)methyl]carbamate
CID 81131007
acetic acid;[2-methyl-1-[(1-methylcyclohexyl)methylcarbamoyloxy]propyl] benzoate
CID 66584300
2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide
CID 103515473
propan-2-yl N-[(1-aminocycloheptyl)methylsulfamoyl]carbamate
CID 114464611
N-(2-amino-2-sulfanylideneethyl)-N'-[(1-methylcyclopentyl)methyl]oxamide
CID 55261793
(2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride
CID 119780580

Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate?
The IUPAC name of propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate (CID 116656090) is propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate.
What is the SMILES notation for propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate?
The canonical SMILES for propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate is CC(C)OC(=O)NCC1(C)CCCC1.
What is the InChIKey of propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate?
The InChIKey is SJJUXPUGHFUDGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-9(2)14-10(13)12-8-11(3)6-4-5-7-11/h9H,4-8H2,1-3H3,(H,12,13).
What are the key properties of propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate?
propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate has a molecular weight of 199.29 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate is sourced from PubChem (CID 116656090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).