2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride

C10H20ClNO2 — CID 21144157

IUPAC2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride
SMILESCC(C)COC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C10H19NO2.ClH/c1-8(2)7-13-9(12)10(11)5-3-4-6-10;/h8H,3-7,11H2,1-2H3;1H
InChIKeyRGOFTPKQAPPOAM-UHFFFAOYSA-N
MW221.73 g/mol
LogP1.88
Rot. Bonds3

About 2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride

2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride (PubChem CID 21144157) has the molecular formula C10H20ClNO2 and a molecular weight of 221.73 g/mol. Its IUPAC name is 2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride.

Molecular Properties

Compound Name2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride
PubChem CID21144157
Molecular FormulaC10H20ClNO2
Molecular Weight221.73 g/mol
Exact Mass221.12
IUPAC Name2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride
SMILESCC(C)COC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C10H19NO2.ClH/c1-8(2)7-13-9(12)10(11)5-3-4-6-10;/h8H,3-7,11H2,1-2H3;1H
InChIKeyRGOFTPKQAPPOAM-UHFFFAOYSA-N
XLogP1.88
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.73
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride?
The IUPAC name of 2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride (CID 21144157) is 2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride.
What is the SMILES notation for 2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride?
The canonical SMILES for 2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride is CC(C)COC(=O)C1(N)CCCC1.Cl.
What is the InChIKey of 2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride?
The InChIKey is RGOFTPKQAPPOAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2.ClH/c1-8(2)7-13-9(12)10(11)5-3-4-6-10;/h8H,3-7,11H2,1-2H3;1H.
What are the key properties of 2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride?
2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride has a molecular weight of 221.73 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropyl 1-aminocyclopentane-1-carboxylate;hydrochloride is sourced from PubChem (CID 21144157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).