N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine

C15H25N3 — CID 114698856

IUPACN-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine
SMILESCc1cnccc1CNC1CCN(C(C)C)CC1
InChIInChI=1S/C15H25N3/c1-12(2)18-8-5-15(6-9-18)17-11-14-4-7-16-10-13(14)3/h4,7,10,12,15,17H,5-6,8-9,11H2,1-3H3
InChIKeyWEXDQZLBDHOMNG-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.35
Rot. Bonds4

About N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine

N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine (PubChem CID 114698856) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine
PubChem CID114698856
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine
SMILESCc1cnccc1CNC1CCN(C(C)C)CC1
InChIInChI=1S/C15H25N3/c1-12(2)18-8-5-15(6-9-18)17-11-14-4-7-16-10-13(14)3/h4,7,10,12,15,17H,5-6,8-9,11H2,1-3H3
InChIKeyWEXDQZLBDHOMNG-UHFFFAOYSA-N
XLogP2.35
TPSA28.16 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 ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-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-[(3-methyl-4-pyridinyl)methyl]-3-propan-2-ylcyclohexan-1-amine
CID 107448832
1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine
CID 114699054
N-[(3-methyl-4-pyridinyl)methyl]-4-phenylcyclohexan-1-amine
CID 114698974
3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine
CID 114699208
N-[(3-methyl-4-pyridinyl)methyl]-1-(5-phenyl-1,3,4-thiadiazol-2-yl)piperidin-4-amine
CID 72913696
N-[(2-bromo-4-methylphenyl)methyl]-1-propan-2-ylpiperidin-4-amine
CID 115556593
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-propan-2-ylazepan-4-amine
CID 65073424
N-[(2,3-difluorophenyl)methyl]-1-propan-2-ylpiperidin-4-amine
CID 63669754
2-[[(1-propan-2-ylazepan-4-yl)amino]methyl]phenol
CID 114331588
N-[(2,4-difluorophenyl)methyl]-1-propan-2-ylpiperidin-4-amine
CID 28716417
N-[(3-methyl-2-nitrophenyl)methyl]-1-propan-2-ylpiperidin-4-amine
CID 58885086
N-[(3-tert-butyl-1-methylpyrazol-4-yl)methyl]-1-propan-2-ylpiperidin-4-amine
CID 83075690

Frequently Asked Questions

What is the IUPAC name of N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine?
The IUPAC name of N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine (CID 114698856) is N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine.
What is the SMILES notation for N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine?
The canonical SMILES for N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine is Cc1cnccc1CNC1CCN(C(C)C)CC1.
What is the InChIKey of N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine?
The InChIKey is WEXDQZLBDHOMNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-12(2)18-8-5-15(6-9-18)17-11-14-4-7-16-10-13(14)3/h4,7,10,12,15,17H,5-6,8-9,11H2,1-3H3.
What are the key properties of N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine?
N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine has a molecular weight of 247.39 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine is sourced from PubChem (CID 114698856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).