N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide

C20H18N6O2 — CID 53233972

IUPACN-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide
SMILESCOc1cccnc1Nc1nc2ccc(-c3cccc(NC(C)=O)c3)cn2n1
InChIInChI=1S/C20H18N6O2/c1-13(27)22-16-6-3-5-14(11-16)15-8-9-18-23-20(25-26(18)12-15)24-19-17(28-2)7-4-10-21-19/h3-12H,1-2H3,(H,22,27)(H,21,24,25)
InChIKeyDZSZUXCODRCZGU-UHFFFAOYSA-N
MW374.40 g/mol
LogP3.50
Rot. Bonds5

About N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide

N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide (PubChem CID 53233972) has the molecular formula C20H18N6O2 and a molecular weight of 374.40 g/mol. Its IUPAC name is N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide
PubChem CID53233972
Molecular FormulaC20H18N6O2
Molecular Weight374.40 g/mol
Exact Mass374.15
IUPAC NameN-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide
SMILESCOc1cccnc1Nc1nc2ccc(-c3cccc(NC(C)=O)c3)cn2n1
InChIInChI=1S/C20H18N6O2/c1-13(27)22-16-6-3-5-14(11-16)15-8-9-18-23-20(25-26(18)12-15)24-19-17(28-2)7-4-10-21-19/h3-12H,1-2H3,(H,22,27)(H,21,24,25)
InChIKeyDZSZUXCODRCZGU-UHFFFAOYSA-N
XLogP3.50
TPSA93.44 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide with MolForge

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Related Compounds

1-[3-[2-(2-methoxyanilino)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]-3-phenylurea
CID 53234900
N-[3-[2-(2-methoxyanilino)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]methanesulfonamide
CID 67216303
1-[3-[2-(2-methoxyanilino)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]-3-(2-morpholin-4-ylethyl)urea
CID 53234984
1-cyclopropyl-N-[3-[2-(2-methoxyanilino)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]methanesulfonamide
CID 53234898
tert-butyl 3-[2-(2-methoxyanilino)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]benzoate;3-[2-(2-methoxyanilino)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]benzoic acid
CID 67216166
N-(2-methoxyphenyl)-6-[3-(methylsulfonylmethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 162129799
N-[3-[1-[(3-methoxy-2-pyridinyl)amino]ethyl]phenyl]acetamide
CID 115923081
1,2-dimethoxybenzene;N-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]acetamide
CID 143409751
N-[3-[6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetamide
CID 59320970
6-[3-(cyclopropylmethylsulfonylmethyl)phenyl]-N-(2-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 159129374
4-[[6-[4-[3-(4-fluorophenyl)-2-oxopropyl]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-3-methoxy-N,N-dimethylbenzamide
CID 158233125
N-[2-[acetyl(methyl)amino]ethyl]-4-[[6-[4-[3-(4-fluorophenyl)-2-oxopropyl]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-3-methoxy-N-methylbenzamide
CID 159253885

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide?
The IUPAC name of N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide (CID 53233972) is N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide.
What is the SMILES notation for N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide?
The canonical SMILES for N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide is COc1cccnc1Nc1nc2ccc(-c3cccc(NC(C)=O)c3)cn2n1.
What is the InChIKey of N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide?
The InChIKey is DZSZUXCODRCZGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N6O2/c1-13(27)22-16-6-3-5-14(11-16)15-8-9-18-23-20(25-26(18)12-15)24-19-17(28-2)7-4-10-21-19/h3-12H,1-2H3,(H,22,27)(H,21,24,25).
What are the key properties of N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide?
N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide has a molecular weight of 374.40 g/mol, XLogP of 3.50, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-[(3-methoxy-2-pyridinyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide is sourced from PubChem (CID 53233972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).