2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine

C14H20N4O — CID 117133730

IUPAC2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine
SMILESCCN1CCC(Cc2nc3cc(OC)ccn3n2)C1
InChIInChI=1S/C14H20N4O/c1-3-17-6-4-11(10-17)8-13-15-14-9-12(19-2)5-7-18(14)16-13/h5,7,9,11H,3-4,6,8,10H2,1-2H3
InChIKeyMFUNWUGNXAFNIE-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.62
Rot. Bonds4

About 2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine

2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 117133730) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID117133730
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine
SMILESCCN1CCC(Cc2nc3cc(OC)ccn3n2)C1
InChIInChI=1S/C14H20N4O/c1-3-17-6-4-11(10-17)8-13-15-14-9-12(19-2)5-7-18(14)16-13/h5,7,9,11H,3-4,6,8,10H2,1-2H3
InChIKeyMFUNWUGNXAFNIE-UHFFFAOYSA-N
XLogP1.62
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

7-chloro-2-[(1-ethylpiperidin-4-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117133947
2-[(1-ethylpyrrolidin-3-yl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 117136107
7-methoxy-2-(pyrrolidin-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117134373
2-[(1-ethylpyrrolidin-3-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 117131432
2-[(1-ethylpiperidin-3-yl)methyl]-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine
CID 117136928
2-[(1-ethylpiperidin-4-yl)methyl]-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine
CID 117136154
2-[(4-bromophenyl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine
CID 117135150
7-chloro-2-[(1-propan-2-ylpiperidin-3-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117134724
2-[(1-ethylpiperidin-4-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 117131561
2-[(2-fluorophenyl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine
CID 117135034
N-[(1-ethylpyrrolidin-3-yl)methyl]-1-(4-methoxyphenyl)propan-1-amine
CID 60855495
7-chloro-2-[(1-ethylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117134466

Frequently Asked Questions

What is the IUPAC name of 2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine (CID 117133730) is 2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine is CCN1CCC(Cc2nc3cc(OC)ccn3n2)C1.
What is the InChIKey of 2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is MFUNWUGNXAFNIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-3-17-6-4-11(10-17)8-13-15-14-9-12(19-2)5-7-18(14)16-13/h5,7,9,11H,3-4,6,8,10H2,1-2H3.
What are the key properties of 2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine?
2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 260.34 g/mol, XLogP of 1.62, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-ethylpyrrolidin-3-yl)methyl]-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 117133730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).