4-(3-methyltriazol-4-yl)pyridin-3-amine

C8H9N5 — CID 90205469

IUPAC4-(3-methyltriazol-4-yl)pyridin-3-amine
SMILESCn1nncc1-c1ccncc1N
InChIInChI=1S/C8H9N5/c1-13-8(5-11-12-13)6-2-3-10-4-7(6)9/h2-5H,9H2,1H3
InChIKeyPAVMNJBWLVFXPK-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.46
Rot. Bonds1

About 4-(3-methyltriazol-4-yl)pyridin-3-amine

4-(3-methyltriazol-4-yl)pyridin-3-amine (PubChem CID 90205469) has the molecular formula C8H9N5 and a molecular weight of 175.19 g/mol. Its IUPAC name is 4-(3-methyltriazol-4-yl)pyridin-3-amine.

Molecular Properties

Compound Name4-(3-methyltriazol-4-yl)pyridin-3-amine
PubChem CID90205469
Molecular FormulaC8H9N5
Molecular Weight175.19 g/mol
Exact Mass175.09
IUPAC Name4-(3-methyltriazol-4-yl)pyridin-3-amine
SMILESCn1nncc1-c1ccncc1N
InChIInChI=1S/C8H9N5/c1-13-8(5-11-12-13)6-2-3-10-4-7(6)9/h2-5H,9H2,1H3
InChIKeyPAVMNJBWLVFXPK-UHFFFAOYSA-N
XLogP0.46
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(1,4-dimethylpyrazol-5-yl)pyridin-3-amine
CID 130527491
4-(4-fluoro-1-methylpyrazol-5-yl)pyridin-3-amine
CID 146487616
4-(2,3,4,5,6-pentamethylphenyl)pyridin-3-amine
CID 83167693
4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine
CID 83166590
4-(5-methyl-1,3-thiazol-2-yl)pyridin-3-amine
CID 82403303
1-methyl-5-(1H-pyrazol-5-yl)triazole
CID 173358547
4-(1-methyl-3-propan-2-ylpyrazol-4-yl)pyridin-3-amine
CID 83166773
4-(4-tert-butylphenyl)pyridin-3-amine
CID 83167595
4-(2,4-dimethylphenyl)pyridin-3-amine
CID 80503034
4-(3-methyltriazol-4-yl)-2,3-dihydro-1H-indole
CID 114689526
4-(4-fluorophenyl)pyridin-3-amine
CID 82405156
[(3-methyltriazol-4-yl)-pyridin-4-ylmethyl]hydrazine
CID 105196426

Frequently Asked Questions

What is the IUPAC name of 4-(3-methyltriazol-4-yl)pyridin-3-amine?
The IUPAC name of 4-(3-methyltriazol-4-yl)pyridin-3-amine (CID 90205469) is 4-(3-methyltriazol-4-yl)pyridin-3-amine.
What is the SMILES notation for 4-(3-methyltriazol-4-yl)pyridin-3-amine?
The canonical SMILES for 4-(3-methyltriazol-4-yl)pyridin-3-amine is Cn1nncc1-c1ccncc1N.
What is the InChIKey of 4-(3-methyltriazol-4-yl)pyridin-3-amine?
The InChIKey is PAVMNJBWLVFXPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5/c1-13-8(5-11-12-13)6-2-3-10-4-7(6)9/h2-5H,9H2,1H3.
What are the key properties of 4-(3-methyltriazol-4-yl)pyridin-3-amine?
4-(3-methyltriazol-4-yl)pyridin-3-amine has a molecular weight of 175.19 g/mol, XLogP of 0.46, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methyltriazol-4-yl)pyridin-3-amine is sourced from PubChem (CID 90205469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).