propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate

C11H21NO2 — CID 116656032

IUPACpropan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate
SMILESCC(C)OC(=O)N(C)CC1CCCC1
InChIInChI=1S/C11H21NO2/c1-9(2)14-11(13)12(3)8-10-6-4-5-7-10/h9-10H,4-8H2,1-3H3
InChIKeyQFLYGVOGLRWHOS-UHFFFAOYSA-N
MW199.29 g/mol
LogP2.65
Rot. Bonds3

About propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate

propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate (PubChem CID 116656032) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate.

Molecular Properties

Compound Namepropan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate
PubChem CID116656032
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Namepropan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate
SMILESCC(C)OC(=O)N(C)CC1CCCC1
InChIInChI=1S/C11H21NO2/c1-9(2)14-11(13)12(3)8-10-6-4-5-7-10/h9-10H,4-8H2,1-3H3
InChIKeyQFLYGVOGLRWHOS-UHFFFAOYSA-N
XLogP2.65
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate?
The IUPAC name of propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate (CID 116656032) is propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate.
What is the SMILES notation for propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate?
The canonical SMILES for propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate is CC(C)OC(=O)N(C)CC1CCCC1.
What is the InChIKey of propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate?
The InChIKey is QFLYGVOGLRWHOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-9(2)14-11(13)12(3)8-10-6-4-5-7-10/h9-10H,4-8H2,1-3H3.
What are the key properties of propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate?
propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate has a molecular weight of 199.29 g/mol, XLogP of 2.65, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-(cyclopentylmethyl)-N-methylcarbamate is sourced from PubChem (CID 116656032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).