5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine

C15H25N3 — CID 102542773

IUPAC5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine
SMILESCCCCN1CCCCC1c1cnc(N)c(C)c1
InChIInChI=1S/C15H25N3/c1-3-4-8-18-9-6-5-7-14(18)13-10-12(2)15(16)17-11-13/h10-11,14H,3-9H2,1-2H3,(H2,16,17)
InChIKeyFPHFTRHSPQTBKP-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.30
Rot. Bonds4

About 5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine

5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine (PubChem CID 102542773) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine.

Molecular Properties

Compound Name5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine
PubChem CID102542773
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine
SMILESCCCCN1CCCCC1c1cnc(N)c(C)c1
InChIInChI=1S/C15H25N3/c1-3-4-8-18-9-6-5-7-14(18)13-10-12(2)15(16)17-11-13/h10-11,14H,3-9H2,1-2H3,(H2,16,17)
InChIKeyFPHFTRHSPQTBKP-UHFFFAOYSA-N
XLogP3.30
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-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 5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine?
The IUPAC name of 5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine (CID 102542773) is 5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine.
What is the SMILES notation for 5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine?
The canonical SMILES for 5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine is CCCCN1CCCCC1c1cnc(N)c(C)c1.
What is the InChIKey of 5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine?
The InChIKey is FPHFTRHSPQTBKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-4-8-18-9-6-5-7-14(18)13-10-12(2)15(16)17-11-13/h10-11,14H,3-9H2,1-2H3,(H2,16,17).
What are the key properties of 5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine?
5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine has a molecular weight of 247.39 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-butylpiperidin-2-yl)-3-methylpyridin-2-amine is sourced from PubChem (CID 102542773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).