N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine

C11H14N4 — CID 116989431

IUPACN-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine
SMILESCNCC1(c2nc3ccccn3n2)CC1
InChIInChI=1S/C11H14N4/c1-12-8-11(5-6-11)10-13-9-4-2-3-7-15(9)14-10/h2-4,7,12H,5-6,8H2,1H3
InChIKeyYEIGLCRYNJNFGH-UHFFFAOYSA-N
MW202.26 g/mol
LogP0.98
Rot. Bonds3

About N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine

N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine (PubChem CID 116989431) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine
PubChem CID116989431
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC NameN-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine
SMILESCNCC1(c2nc3ccccn3n2)CC1
InChIInChI=1S/C11H14N4/c1-12-8-11(5-6-11)10-13-9-4-2-3-7-15(9)14-10/h2-4,7,12H,5-6,8H2,1H3
InChIKeyYEIGLCRYNJNFGH-UHFFFAOYSA-N
XLogP0.98
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine?
The IUPAC name of N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine (CID 116989431) is N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine.
What is the SMILES notation for N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine?
The canonical SMILES for N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine is CNCC1(c2nc3ccccn3n2)CC1.
What is the InChIKey of N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine?
The InChIKey is YEIGLCRYNJNFGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c1-12-8-11(5-6-11)10-13-9-4-2-3-7-15(9)14-10/h2-4,7,12H,5-6,8H2,1H3.
What are the key properties of N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine?
N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine has a molecular weight of 202.26 g/mol, XLogP of 0.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-([1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropyl]methanamine is sourced from PubChem (CID 116989431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).