N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine

C8H14N2 — CID 56972751

IUPACN-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine
SMILESC=CCNC1=NCCCC1
InChIInChI=1S/C8H14N2/c1-2-6-9-8-5-3-4-7-10-8/h2H,1,3-7H2,(H,9,10)
InChIKeyRPWWSJGVLJWIFL-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.34
Rot. Bonds2

About N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine

N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine (PubChem CID 56972751) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine.

Molecular Properties

Compound NameN-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine
PubChem CID56972751
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC NameN-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine
SMILESC=CCNC1=NCCCC1
InChIInChI=1S/C8H14N2/c1-2-6-9-8-5-3-4-7-10-8/h2H,1,3-7H2,(H,9,10)
InChIKeyRPWWSJGVLJWIFL-UHFFFAOYSA-N
XLogP1.34
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-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-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine?
The IUPAC name of N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine (CID 56972751) is N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine.
What is the SMILES notation for N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine?
The canonical SMILES for N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine is C=CCNC1=NCCCC1.
What is the InChIKey of N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine?
The InChIKey is RPWWSJGVLJWIFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-2-6-9-8-5-3-4-7-10-8/h2H,1,3-7H2,(H,9,10).
What are the key properties of N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine?
N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine has a molecular weight of 138.21 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enyl-2,3,4,5-tetrahydropyridin-6-amine is sourced from PubChem (CID 56972751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).