(3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine

C11H18N4 — CID 83866489

IUPAC(3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine
SMILESNCC1CCCc2nnc(C3CCC3)n21
InChIInChI=1S/C11H18N4/c12-7-9-5-2-6-10-13-14-11(15(9)10)8-3-1-4-8/h8-9H,1-7,12H2
InChIKeyMAYHTXNHPPFNSJ-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.38
Rot. Bonds2

About (3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine

(3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine (PubChem CID 83866489) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is (3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine.

Molecular Properties

Compound Name(3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine
PubChem CID83866489
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name(3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine
SMILESNCC1CCCc2nnc(C3CCC3)n21
InChIInChI=1S/C11H18N4/c12-7-9-5-2-6-10-13-14-11(15(9)10)8-3-1-4-8/h8-9H,1-7,12H2
InChIKeyMAYHTXNHPPFNSJ-UHFFFAOYSA-N
XLogP1.38
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine with MolForge

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Related Compounds

[3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine
CID 83866488
[3-(1,1-dioxothian-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanol
CID 117149482
(3-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl)methanamine
CID 83829886
(3-chloro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-yl)methanamine
CID 83869944
(3-chloro-2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-yl)methanamine
CID 83869946
3-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)cyclohexan-1-amine
CID 63044408
[2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)cyclopentyl]methanamine
CID 81057520
(3-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanol
CID 117149677
(5-cycloheptyl-4-cyclopropyl-1,2,4-triazol-3-yl)methanamine
CID 112593244
(2-bromo-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-5-yl)methanamine
CID 83867313
2-(2-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-5-yl)ethanamine
CID 83866071
5-methyl-3-pyrrolidin-3-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
CID 117149794

Frequently Asked Questions

What is the IUPAC name of (3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine?
The IUPAC name of (3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine (CID 83866489) is (3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine.
What is the SMILES notation for (3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine?
The canonical SMILES for (3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine is NCC1CCCc2nnc(C3CCC3)n21.
What is the InChIKey of (3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine?
The InChIKey is MAYHTXNHPPFNSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c12-7-9-5-2-6-10-13-14-11(15(9)10)8-3-1-4-8/h8-9H,1-7,12H2.
What are the key properties of (3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine?
(3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine has a molecular weight of 206.29 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclobutyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanamine is sourced from PubChem (CID 83866489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).