2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine

C14H16N6 — CID 107064195

IUPAC2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine
SMILESCn1cc(CC(N)c2cnn(-c3ccccc3)c2)nn1
InChIInChI=1S/C14H16N6/c1-19-10-12(17-18-19)7-14(15)11-8-16-20(9-11)13-5-3-2-4-6-13/h2-6,8-10,14H,7,15H2,1H3
InChIKeyJWDMUJFVBLUZMU-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.24
Rot. Bonds4

About 2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine

2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine (PubChem CID 107064195) has the molecular formula C14H16N6 and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine
PubChem CID107064195
Molecular FormulaC14H16N6
Molecular Weight268.32 g/mol
Exact Mass268.14
IUPAC Name2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine
SMILESCn1cc(CC(N)c2cnn(-c3ccccc3)c2)nn1
InChIInChI=1S/C14H16N6/c1-19-10-12(17-18-19)7-14(15)11-8-16-20(9-11)13-5-3-2-4-6-13/h2-6,8-10,14H,7,15H2,1H3
InChIKeyJWDMUJFVBLUZMU-UHFFFAOYSA-N
XLogP1.24
TPSA74.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine 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

2-(1-methyltriazol-4-yl)-1-(2-phenyltriazol-4-yl)ethanol
CID 107065645
1-(4-methoxyphenyl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107048287
methyl (3R)-3-amino-3-(1-phenylpyrazol-4-yl)propanoate
CID 29059511
methyl 3-amino-3-(1-phenylpyrazol-4-yl)propanoate
CID 43147874
1-(3-methylimidazol-4-yl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107050777
[2-(1-methylpyrazol-3-yl)-1-(1-phenylpyrazol-4-yl)ethyl]hydrazine
CID 105329489
[2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-3-yl)ethyl]hydrazine
CID 107066649
2-(oxan-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine
CID 105138644
2-cycloheptyl-1-(1-phenylpyrazol-4-yl)ethanamine
CID 114457498
4-(1-chloro-3-methylbutyl)-1-phenylpyrazole
CID 61085631
N-methyl-2-(1-methyltriazol-4-yl)-1-phenylethanamine
CID 107048557
2-methyl-1-(1-phenylpyrazol-4-yl)prop-2-en-1-amine
CID 105163593

Frequently Asked Questions

What is the IUPAC name of 2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine?
The IUPAC name of 2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine (CID 107064195) is 2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine.
What is the SMILES notation for 2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine?
The canonical SMILES for 2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine is Cn1cc(CC(N)c2cnn(-c3ccccc3)c2)nn1.
What is the InChIKey of 2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine?
The InChIKey is JWDMUJFVBLUZMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6/c1-19-10-12(17-18-19)7-14(15)11-8-16-20(9-11)13-5-3-2-4-6-13/h2-6,8-10,14H,7,15H2,1H3.
What are the key properties of 2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine?
2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine has a molecular weight of 268.32 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-4-yl)ethanamine is sourced from PubChem (CID 107064195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).