(3-aminocyclopentyl) N-propan-2-ylcarbamate

C9H18N2O2 — CID 79465230

IUPAC(3-aminocyclopentyl) N-propan-2-ylcarbamate
SMILESCC(C)NC(=O)OC1CCC(N)C1
InChIInChI=1S/C9H18N2O2/c1-6(2)11-9(12)13-8-4-3-7(10)5-8/h6-8H,3-5,10H2,1-2H3,(H,11,12)
InChIKeyYDGPUFLZROEYJF-UHFFFAOYSA-N
MW186.25 g/mol
LogP1.00
Rot. Bonds2

About (3-aminocyclopentyl) N-propan-2-ylcarbamate

(3-aminocyclopentyl) N-propan-2-ylcarbamate (PubChem CID 79465230) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is (3-aminocyclopentyl) N-propan-2-ylcarbamate.

Molecular Properties

Compound Name(3-aminocyclopentyl) N-propan-2-ylcarbamate
PubChem CID79465230
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name(3-aminocyclopentyl) N-propan-2-ylcarbamate
SMILESCC(C)NC(=O)OC1CCC(N)C1
InChIInChI=1S/C9H18N2O2/c1-6(2)11-9(12)13-8-4-3-7(10)5-8/h6-8H,3-5,10H2,1-2H3,(H,11,12)
InChIKeyYDGPUFLZROEYJF-UHFFFAOYSA-N
XLogP1.00
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3-aminocyclopentyl) N-propan-2-ylcarbamate 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 (3-aminocyclopentyl) N-propan-2-ylcarbamate?
The IUPAC name of (3-aminocyclopentyl) N-propan-2-ylcarbamate (CID 79465230) is (3-aminocyclopentyl) N-propan-2-ylcarbamate.
What is the SMILES notation for (3-aminocyclopentyl) N-propan-2-ylcarbamate?
The canonical SMILES for (3-aminocyclopentyl) N-propan-2-ylcarbamate is CC(C)NC(=O)OC1CCC(N)C1.
What is the InChIKey of (3-aminocyclopentyl) N-propan-2-ylcarbamate?
The InChIKey is YDGPUFLZROEYJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-6(2)11-9(12)13-8-4-3-7(10)5-8/h6-8H,3-5,10H2,1-2H3,(H,11,12).
What are the key properties of (3-aminocyclopentyl) N-propan-2-ylcarbamate?
(3-aminocyclopentyl) N-propan-2-ylcarbamate has a molecular weight of 186.25 g/mol, XLogP of 1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminocyclopentyl) N-propan-2-ylcarbamate is sourced from PubChem (CID 79465230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).