3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine

C14H23N3 — CID 28657609

IUPAC3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine
SMILESc1ccc(CNCCCN2CCCCC2)nc1
InChIInChI=1S/C14H23N3/c1-4-10-17(11-5-1)12-6-8-15-13-14-7-2-3-9-16-14/h2-3,7,9,15H,1,4-6,8,10-13H2
InChIKeyGSORIQZEYJWZLY-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.05
Rot. Bonds6

About 3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine

3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine (PubChem CID 28657609) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine
PubChem CID28657609
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine
SMILESc1ccc(CNCCCN2CCCCC2)nc1
InChIInChI=1S/C14H23N3/c1-4-10-17(11-5-1)12-6-8-15-13-14-7-2-3-9-16-14/h2-3,7,9,15H,1,4-6,8,10-13H2
InChIKeyGSORIQZEYJWZLY-UHFFFAOYSA-N
XLogP2.05
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-ethylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)ethanamine
CID 55024068
2-(4-methylazepan-1-yl)-N-(pyridin-2-ylmethyl)ethanamine
CID 63626313
1-[4-(piperidin-1-ylmethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine
CID 83962786
N-[(2-methyl-3-pyridinyl)methyl]-3-pyrrolidin-1-ylpropan-1-amine
CID 112689529
N-[(1-methylimidazol-4-yl)methyl]-3-piperidin-1-ylpropan-1-amine
CID 107972077
N-[(5-methylpyrazin-2-yl)methyl]-3-piperidin-1-ylpropan-1-amine
CID 112700188
3-morpholin-4-yl-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 60649527
N'-(pyridin-2-ylmethyl)-N-[2-(pyridin-2-ylmethylamino)ethyl]ethane-1,2-diamine
CID 12029921
4-pyridin-2-yl-N-(pyridin-2-ylmethyl)butan-1-amine
CID 158855450
3-bromo-N-(pyridin-2-ylmethyl)propan-1-amine
CID 114293539
2-(4-propan-2-ylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)ethanamine
CID 103503493
3-piperidin-1-yl-N-(pyridazin-4-ylmethyl)propan-1-amine
CID 113439259

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine?
The IUPAC name of 3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine (CID 28657609) is 3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine.
What is the SMILES notation for 3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine?
The canonical SMILES for 3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine is c1ccc(CNCCCN2CCCCC2)nc1.
What is the InChIKey of 3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine?
The InChIKey is GSORIQZEYJWZLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-4-10-17(11-5-1)12-6-8-15-13-14-7-2-3-9-16-14/h2-3,7,9,15H,1,4-6,8,10-13H2.
What are the key properties of 3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine?
3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine has a molecular weight of 233.36 g/mol, XLogP of 2.05, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-yl-N-(pyridin-2-ylmethyl)propan-1-amine is sourced from PubChem (CID 28657609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).