N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide

C19H20N4O2 — CID 86763634

IUPACN-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cccn2c(C3CCCC3)nnc12
InChIInChI=1S/C19H20N4O2/c1-25-16-11-5-4-9-14(16)19(24)20-15-10-6-12-23-17(21-22-18(15)23)13-7-2-3-8-13/h4-6,9-13H,2-3,7-8H2,1H3,(H,20,24)
InChIKeyAVIQZSSSNZCCCQ-UHFFFAOYSA-N
MW336.40 g/mol
LogP3.65
Rot. Bonds4

About N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide

N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide (PubChem CID 86763634) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide.

Molecular Properties

Compound NameN-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide
PubChem CID86763634
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC NameN-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cccn2c(C3CCCC3)nnc12
InChIInChI=1S/C19H20N4O2/c1-25-16-11-5-4-9-14(16)19(24)20-15-10-6-12-23-17(21-22-18(15)23)13-7-2-3-8-13/h4-6,9-13H,2-3,7-8H2,1H3,(H,20,24)
InChIKeyAVIQZSSSNZCCCQ-UHFFFAOYSA-N
XLogP3.65
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-cyclobutyl-N-(2-methoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 86764840
2-methoxy-N-(3-pyridin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)benzamide
CID 86763860
N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)pyridine-2-carboxamide
CID 53166367
N-cyclohexyl-2-[(2-methoxybenzoyl)amino]-N-methylbenzamide
CID 4938981
N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)thiophene-3-carboxamide
CID 53166357
N-(2-acetamidophenyl)-2-methoxybenzamide
CID 113093661
2-methoxy-N-(9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide
CID 18891605
methyl 3-(1,1-dioxothian-3-yl)-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylate
CID 117147483
8-methoxy-3-(1-methylpiperidin-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117145448
3-[(2-methoxybenzoyl)amino]pyridine-2-carboxylic acid
CID 104740315
2-(8-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)thiane 1,1-dioxide
CID 117145442
2-methoxy-N-(2-prop-1-en-2-ylphenyl)benzamide
CID 175134678

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide?
The IUPAC name of N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide (CID 86763634) is N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide.
What is the SMILES notation for N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide?
The canonical SMILES for N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide is COc1ccccc1C(=O)Nc1cccn2c(C3CCCC3)nnc12.
What is the InChIKey of N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide?
The InChIKey is AVIQZSSSNZCCCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-25-16-11-5-4-9-14(16)19(24)20-15-10-6-12-23-17(21-22-18(15)23)13-7-2-3-8-13/h4-6,9-13H,2-3,7-8H2,1H3,(H,20,24).
What are the key properties of N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide?
N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide has a molecular weight of 336.40 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-methoxybenzamide is sourced from PubChem (CID 86763634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).