N-(5-ethoxypentyl)piperidin-4-amine

C12H26N2O — CID 164907072

IUPACN-(5-ethoxypentyl)piperidin-4-amine
SMILESCCOCCCCCNC1CCNCC1
InChIInChI=1S/C12H26N2O/c1-2-15-11-5-3-4-8-14-12-6-9-13-10-7-12/h12-14H,2-11H2,1H3
InChIKeyQBIKYQLDPBESJW-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.53
Rot. Bonds8

About N-(5-ethoxypentyl)piperidin-4-amine

N-(5-ethoxypentyl)piperidin-4-amine (PubChem CID 164907072) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-(5-ethoxypentyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(5-ethoxypentyl)piperidin-4-amine
PubChem CID164907072
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-(5-ethoxypentyl)piperidin-4-amine
SMILESCCOCCCCCNC1CCNCC1
InChIInChI=1S/C12H26N2O/c1-2-15-11-5-3-4-8-14-12-6-9-13-10-7-12/h12-14H,2-11H2,1H3
InChIKeyQBIKYQLDPBESJW-UHFFFAOYSA-N
XLogP1.53
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(5-ethoxypentyl)piperidin-4-amine 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-(5-ethoxypentyl)piperidin-4-amine?
The IUPAC name of N-(5-ethoxypentyl)piperidin-4-amine (CID 164907072) is N-(5-ethoxypentyl)piperidin-4-amine.
What is the SMILES notation for N-(5-ethoxypentyl)piperidin-4-amine?
The canonical SMILES for N-(5-ethoxypentyl)piperidin-4-amine is CCOCCCCCNC1CCNCC1.
What is the InChIKey of N-(5-ethoxypentyl)piperidin-4-amine?
The InChIKey is QBIKYQLDPBESJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-2-15-11-5-3-4-8-14-12-6-9-13-10-7-12/h12-14H,2-11H2,1H3.
What are the key properties of N-(5-ethoxypentyl)piperidin-4-amine?
N-(5-ethoxypentyl)piperidin-4-amine has a molecular weight of 214.35 g/mol, XLogP of 1.53, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethoxypentyl)piperidin-4-amine is sourced from PubChem (CID 164907072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).