(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine

C10H12N4 — CID 83866625

IUPAC(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine
SMILESNCc1ccc2nnc(C3CC3)n2c1
InChIInChI=1S/C10H12N4/c11-5-7-1-4-9-12-13-10(8-2-3-8)14(9)6-7/h1,4,6,8H,2-3,5,11H2
InChIKeyOIXUOPXTJOTMRU-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.07
Rot. Bonds2

About (3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine

(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine (PubChem CID 83866625) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is (3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine.

Molecular Properties

Compound Name(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine
PubChem CID83866625
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine
SMILESNCc1ccc2nnc(C3CC3)n2c1
InChIInChI=1S/C10H12N4/c11-5-7-1-4-9-12-13-10(8-2-3-8)14(9)6-7/h1,4,6,8H,2-3,5,11H2
InChIKeyOIXUOPXTJOTMRU-UHFFFAOYSA-N
XLogP1.07
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(thian-3-yl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]methanamine
CID 117138239
1-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propan-2-one
CID 83893633
4-(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)cyclohexan-1-amine
CID 65349561
[3-(pyrrolidin-2-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]methanamine
CID 117138284
[3-(thiolan-2-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]methanamine
CID 117138281
3-cyclopropyl-N-[(4-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 134796645
6-chloro-3-(thian-4-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117138805
6-bromo-3-(oxan-4-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 66570785
4-[6-(aminomethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]phenol
CID 137006529
6-methyl-3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117138815
6-methyl-3-(oxan-4-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117138783
(3-butan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine
CID 82506769

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine?
The IUPAC name of (3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine (CID 83866625) is (3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine.
What is the SMILES notation for (3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine?
The canonical SMILES for (3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine is NCc1ccc2nnc(C3CC3)n2c1.
What is the InChIKey of (3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine?
The InChIKey is OIXUOPXTJOTMRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c11-5-7-1-4-9-12-13-10(8-2-3-8)14(9)6-7/h1,4,6,8H,2-3,5,11H2.
What are the key properties of (3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine?
(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine has a molecular weight of 188.23 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methanamine is sourced from PubChem (CID 83866625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).