N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine

C16H25N5 — CID 61167513

IUPACN-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine
SMILESCC(C)CC(CC(C)C)Nc1cccnc1-n1cncn1
InChIInChI=1S/C16H25N5/c1-12(2)8-14(9-13(3)4)20-15-6-5-7-18-16(15)21-11-17-10-19-21/h5-7,10-14,20H,8-9H2,1-4H3
InChIKeyUZAZUZKYWNESIT-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.54
Rot. Bonds7

About N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine

N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine (PubChem CID 61167513) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound NameN-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine
PubChem CID61167513
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC NameN-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine
SMILESCC(C)CC(CC(C)C)Nc1cccnc1-n1cncn1
InChIInChI=1S/C16H25N5/c1-12(2)8-14(9-13(3)4)20-15-6-5-7-18-16(15)21-11-17-10-19-21/h5-7,10-14,20H,8-9H2,1-4H3
InChIKeyUZAZUZKYWNESIT-UHFFFAOYSA-N
XLogP3.54
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-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-[1-(4-chlorophenyl)ethyl]-2-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 61166360
N-[4-(furan-2-yl)butan-2-yl]-2-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 61167524
N-hexyl-2-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 61167520
4-amino-3-methyl-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]butanamide
CID 81087312
N-[(4-ethylphenyl)methyl]-2-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 61166356
N-[(3-chloro-4-methylphenyl)methyl]-2-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 106816674
N-(pyridin-2-ylmethyl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 61167331
(2S)-2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]butanamide;dihydrochloride
CID 119859600
2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
CID 62046673
N-(3-phenylpropyl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 61167508
1-chloro-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methanesulfonamide
CID 63665812
8-methyl-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 61167703

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine?
The IUPAC name of N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine (CID 61167513) is N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine.
What is the SMILES notation for N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine?
The canonical SMILES for N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine is CC(C)CC(CC(C)C)Nc1cccnc1-n1cncn1.
What is the InChIKey of N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine?
The InChIKey is UZAZUZKYWNESIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-12(2)8-14(9-13(3)4)20-15-6-5-7-18-16(15)21-11-17-10-19-21/h5-7,10-14,20H,8-9H2,1-4H3.
What are the key properties of N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine?
N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine has a molecular weight of 287.41 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylheptan-4-yl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 61167513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).