N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine

C15H25N3 — CID 80629285

IUPACN-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine
SMILESCCCNCc1cnc(N2CCCCC2)c(C)c1
InChIInChI=1S/C15H25N3/c1-3-7-16-11-14-10-13(2)15(17-12-14)18-8-5-4-6-9-18/h10,12,16H,3-9,11H2,1-2H3
InChIKeyCNRQYYYRUCWXKB-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.88
Rot. Bonds5

About N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine

N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine (PubChem CID 80629285) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine
PubChem CID80629285
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine
SMILESCCCNCc1cnc(N2CCCCC2)c(C)c1
InChIInChI=1S/C15H25N3/c1-3-7-16-11-14-10-13(2)15(17-12-14)18-8-5-4-6-9-18/h10,12,16H,3-9,11H2,1-2H3
InChIKeyCNRQYYYRUCWXKB-UHFFFAOYSA-N
XLogP2.88
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]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

N-[(5-methyl-6-pyrrolidin-1-yl-3-pyridinyl)methyl]propan-1-amine
CID 80629075
N-[[5-methyl-6-(1,4-thiazepan-4-yl)-3-pyridinyl]methyl]propan-1-amine
CID 80629616
N-[[6-(azepan-1-yl)-5-methyl-3-pyridinyl]methyl]-2-methoxyethanamine
CID 80629363
N-[[6-(4-ethylazepan-1-yl)-5-methyl-3-pyridinyl]methyl]propan-1-amine
CID 80638418
N-[[6-(1,1-dioxo-1,4-thiazinan-4-yl)-5-methyl-3-pyridinyl]methyl]propan-1-amine
CID 80630835
N-[[6-(3-methoxypiperidin-1-yl)-5-methyl-3-pyridinyl]methyl]propan-1-amine
CID 102961607
(5-methyl-6-piperidin-1-yl-3-pyridinyl)methanamine
CID 79885911
[6-(azepan-1-yl)-5-methyl-3-pyridinyl]methanol
CID 79884523
N-[(5-methyl-6-pyrazol-1-yl-3-pyridinyl)methyl]propan-1-amine
CID 80635268
1-[3-methyl-5-(propylaminomethyl)-2-pyridinyl]pyrrolidine-2-carboxamide
CID 80630801
[1-[5-(ethylaminomethyl)-3-methyl-2-pyridinyl]piperidin-4-yl]methanol
CID 80629576
1-[5-(ethylaminomethyl)-3-methyl-2-pyridinyl]piperidin-3-ol
CID 80630199

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine?
The IUPAC name of N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine (CID 80629285) is N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine.
What is the SMILES notation for N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine?
The canonical SMILES for N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine is CCCNCc1cnc(N2CCCCC2)c(C)c1.
What is the InChIKey of N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine?
The InChIKey is CNRQYYYRUCWXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-7-16-11-14-10-13(2)15(17-12-14)18-8-5-4-6-9-18/h10,12,16H,3-9,11H2,1-2H3.
What are the key properties of N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine?
N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine has a molecular weight of 247.39 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-6-piperidin-1-yl-3-pyridinyl)methyl]propan-1-amine is sourced from PubChem (CID 80629285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).