N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine

C16H27N3 — CID 43371759

IUPACN-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine
SMILESCC(C)CC(C)NC1CCN(c2ccncc2)CC1
InChIInChI=1S/C16H27N3/c1-13(2)12-14(3)18-15-6-10-19(11-7-15)16-4-8-17-9-5-16/h4-5,8-9,13-15,18H,6-7,10-12H2,1-3H3
InChIKeyVQKYDEYQFYNREL-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.07
Rot. Bonds5

About N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine

N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine (PubChem CID 43371759) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine
PubChem CID43371759
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC NameN-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine
SMILESCC(C)CC(C)NC1CCN(c2ccncc2)CC1
InChIInChI=1S/C16H27N3/c1-13(2)12-14(3)18-15-6-10-19(11-7-15)16-4-8-17-9-5-16/h4-5,8-9,13-15,18H,6-7,10-12H2,1-3H3
InChIKeyVQKYDEYQFYNREL-UHFFFAOYSA-N
XLogP3.07
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-methylpentan-2-yl)-1-pyridin-4-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

1-pyridin-4-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 43343794
2-methyl-3-[(1-pyridin-4-ylpiperidin-4-yl)amino]propan-1-ol
CID 65034705
N-pent-1-yn-3-yl-1-pyridin-4-ylpiperidin-4-amine
CID 114160675
1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine
CID 43343781
1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine
CID 43343785
1-pyridin-4-yl-N-(1-thiophen-3-ylethyl)piperidin-4-amine
CID 62841839
N-(4-methylpentan-2-yl)-1-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-4-amine
CID 46993017
N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine
CID 43166652
N-(4-methylpentan-2-yl)-1-propan-2-ylpiperidin-4-amine
CID 43206641
N-(2,5-dimethylpyrrol-1-yl)-1-pyridin-4-ylpiperidin-4-amine
CID 79101320
N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine
CID 113463722
N-butan-2-yl-1-pyridin-4-ylpiperidine-4-carboxamide
CID 46384683

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine?
The IUPAC name of N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine (CID 43371759) is N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine.
What is the SMILES notation for N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine?
The canonical SMILES for N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine is CC(C)CC(C)NC1CCN(c2ccncc2)CC1.
What is the InChIKey of N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine?
The InChIKey is VQKYDEYQFYNREL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-13(2)12-14(3)18-15-6-10-19(11-7-15)16-4-8-17-9-5-16/h4-5,8-9,13-15,18H,6-7,10-12H2,1-3H3.
What are the key properties of N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine?
N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine has a molecular weight of 261.41 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpentan-2-yl)-1-pyridin-4-ylpiperidin-4-amine is sourced from PubChem (CID 43371759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).