N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C14H21N5 — CID 83113703

IUPACN-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCN(C)C1(CNc2nc3ccccn3n2)CCCC1
InChIInChI=1S/C14H21N5/c1-18(2)14(8-4-5-9-14)11-15-13-16-12-7-3-6-10-19(12)17-13/h3,6-7,10H,4-5,8-9,11H2,1-2H3,(H,15,17)
InChIKeyPTHTVOXVBIYWAL-UHFFFAOYSA-N
MW259.36 g/mol
LogP2.02
Rot. Bonds4

About N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 83113703) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID83113703
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC NameN-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCN(C)C1(CNc2nc3ccccn3n2)CCCC1
InChIInChI=1S/C14H21N5/c1-18(2)14(8-4-5-9-14)11-15-13-16-12-7-3-6-10-19(12)17-13/h3,6-7,10H,4-5,8-9,11H2,1-2H3,(H,15,17)
InChIKeyPTHTVOXVBIYWAL-UHFFFAOYSA-N
XLogP2.02
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 83113703) is N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is CN(C)C1(CNc2nc3ccccn3n2)CCCC1.
What is the InChIKey of N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is PTHTVOXVBIYWAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-18(2)14(8-4-5-9-14)11-15-13-16-12-7-3-6-10-19(12)17-13/h3,6-7,10H,4-5,8-9,11H2,1-2H3,(H,15,17).
What are the key properties of N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 259.36 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclopentyl]methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 83113703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).