N-(1-methoxyhexan-2-yl)cyclopentanamine

C12H25NO — CID 115704960

IUPACN-(1-methoxyhexan-2-yl)cyclopentanamine
SMILESCCCCC(COC)NC1CCCC1
InChIInChI=1S/C12H25NO/c1-3-4-7-12(10-14-2)13-11-8-5-6-9-11/h11-13H,3-10H2,1-2H3
InChIKeySOBIBLODASOKEL-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.72
Rot. Bonds7

About N-(1-methoxyhexan-2-yl)cyclopentanamine

N-(1-methoxyhexan-2-yl)cyclopentanamine (PubChem CID 115704960) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is N-(1-methoxyhexan-2-yl)cyclopentanamine.

Molecular Properties

Compound NameN-(1-methoxyhexan-2-yl)cyclopentanamine
PubChem CID115704960
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC NameN-(1-methoxyhexan-2-yl)cyclopentanamine
SMILESCCCCC(COC)NC1CCCC1
InChIInChI=1S/C12H25NO/c1-3-4-7-12(10-14-2)13-11-8-5-6-9-11/h11-13H,3-10H2,1-2H3
InChIKeySOBIBLODASOKEL-UHFFFAOYSA-N
XLogP2.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1-methoxyhexan-2-yl)cyclopentanamine 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 N-(1-methoxyhexan-2-yl)cyclopentanamine?
The IUPAC name of N-(1-methoxyhexan-2-yl)cyclopentanamine (CID 115704960) is N-(1-methoxyhexan-2-yl)cyclopentanamine.
What is the SMILES notation for N-(1-methoxyhexan-2-yl)cyclopentanamine?
The canonical SMILES for N-(1-methoxyhexan-2-yl)cyclopentanamine is CCCCC(COC)NC1CCCC1.
What is the InChIKey of N-(1-methoxyhexan-2-yl)cyclopentanamine?
The InChIKey is SOBIBLODASOKEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-3-4-7-12(10-14-2)13-11-8-5-6-9-11/h11-13H,3-10H2,1-2H3.
What are the key properties of N-(1-methoxyhexan-2-yl)cyclopentanamine?
N-(1-methoxyhexan-2-yl)cyclopentanamine has a molecular weight of 199.34 g/mol, XLogP of 2.72, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxyhexan-2-yl)cyclopentanamine is sourced from PubChem (CID 115704960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).