N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide

C19H20N4O2 — CID 46834673

IUPACN-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide
SMILESCOc1ccc(-c2ccc(CNC(C)=O)cc2)n2nc(C3CC3)nc12
InChIInChI=1S/C19H20N4O2/c1-12(24)20-11-13-3-5-14(6-4-13)16-9-10-17(25-2)19-21-18(15-7-8-15)22-23(16)19/h3-6,9-10,15H,7-8,11H2,1-2H3,(H,20,24)
InChIKeyXBMLZAWOHDMMPU-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.92
Rot. Bonds5

About N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide

N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide (PubChem CID 46834673) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide
PubChem CID46834673
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC NameN-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide
SMILESCOc1ccc(-c2ccc(CNC(C)=O)cc2)n2nc(C3CC3)nc12
InChIInChI=1S/C19H20N4O2/c1-12(24)20-11-13-3-5-14(6-4-13)16-9-10-17(25-2)19-21-18(15-7-8-15)22-23(16)19/h3-6,9-10,15H,7-8,11H2,1-2H3,(H,20,24)
InChIKeyXBMLZAWOHDMMPU-UHFFFAOYSA-N
XLogP2.92
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide with MolForge

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Related Compounds

CID 88576732
CID 88576732
1-[5-(4-cyanophenyl)-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-(pyridin-3-ylmethyl)cyclopropane-1-carboxamide
CID 58074651
1-[5-(4-aminophenyl)-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-(2-methylsulfonylethyl)cyclopropane-1-carboxamide
CID 70230839
N-[(4-methoxyphenyl)methyl]acetamide;hydrochloride
CID 139808929
2-(hydroxymethyl)-4-[8-methoxy-2-[1-(2-methylpropylcarbamoyl)cyclopropyl]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzoic acid
CID 162672122
N-[(4-cyclopentylphenyl)methyl]acetamide
CID 66695215
1-[5-(3-aminophenyl)-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-(2-hydroxyethyl)cyclopropane-1-carboxamide
CID 70228749
1-[5-(3-cyanophenyl)-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-N-(2-hydroxyethyl)cyclopropane-1-carboxamide
CID 58074668
N-[[4-[2-(3,4-dimethoxyphenyl)pyrrolidine-1-carbonyl]phenyl]methyl]acetamide
CID 18154932
[1-[5-(4-cyano-3-methoxyphenyl)-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropyl]methyl N-cyclohexylcarbamate
CID 58074608
ethane;N-[(4-ethylphenyl)methyl]acetamide
CID 143474952
2-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)azetidin-1-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
CID 71783603

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide?
The IUPAC name of N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide (CID 46834673) is N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide.
What is the SMILES notation for N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide?
The canonical SMILES for N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide is COc1ccc(-c2ccc(CNC(C)=O)cc2)n2nc(C3CC3)nc12.
What is the InChIKey of N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide?
The InChIKey is XBMLZAWOHDMMPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-12(24)20-11-13-3-5-14(6-4-13)16-9-10-17(25-2)19-21-18(15-7-8-15)22-23(16)19/h3-6,9-10,15H,7-8,11H2,1-2H3,(H,20,24).
What are the key properties of N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide?
N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide has a molecular weight of 336.40 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide is sourced from PubChem (CID 46834673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).