2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine

C10H20N2 — CID 89216002

IUPAC2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine
SMILESCC(C)C1=CCN(CCN)CC1
InChIInChI=1S/C10H20N2/c1-9(2)10-3-6-12(7-4-10)8-5-11/h3,9H,4-8,11H2,1-2H3
InChIKeyWQQAGYDYXWOXHS-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.23
Rot. Bonds3

About 2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine

2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine (PubChem CID 89216002) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine
PubChem CID89216002
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine
SMILESCC(C)C1=CCN(CCN)CC1
InChIInChI=1S/C10H20N2/c1-9(2)10-3-6-12(7-4-10)8-5-11/h3,9H,4-8,11H2,1-2H3
InChIKeyWQQAGYDYXWOXHS-UHFFFAOYSA-N
XLogP1.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine 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-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine?
The IUPAC name of 2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine (CID 89216002) is 2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine.
What is the SMILES notation for 2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine?
The canonical SMILES for 2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine is CC(C)C1=CCN(CCN)CC1.
What is the InChIKey of 2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine?
The InChIKey is WQQAGYDYXWOXHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-9(2)10-3-6-12(7-4-10)8-5-11/h3,9H,4-8,11H2,1-2H3.
What are the key properties of 2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine?
2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine has a molecular weight of 168.28 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)ethanamine is sourced from PubChem (CID 89216002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).