N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide

C16H20N6O4 — CID 146068380

IUPACN-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NCc2nnn3c2CN(C)C(=O)C3C)c(OC)n1
InChIInChI=1S/C16H20N6O4/c1-9-16(24)21(2)8-12-11(19-20-22(9)12)7-17-14(23)10-5-6-13(25-3)18-15(10)26-4/h5-6,9H,7-8H2,1-4H3,(H,17,23)
InChIKeyFTQRZCOWAJDHPJ-UHFFFAOYSA-N
MW360.37 g/mol
LogP0.15
Rot. Bonds5

About N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide

N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide (PubChem CID 146068380) has the molecular formula C16H20N6O4 and a molecular weight of 360.37 g/mol. Its IUPAC name is N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide
PubChem CID146068380
Molecular FormulaC16H20N6O4
Molecular Weight360.37 g/mol
Exact Mass360.15
IUPAC NameN-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NCc2nnn3c2CN(C)C(=O)C3C)c(OC)n1
InChIInChI=1S/C16H20N6O4/c1-9-16(24)21(2)8-12-11(19-20-22(9)12)7-17-14(23)10-5-6-13(25-3)18-15(10)26-4/h5-6,9H,7-8H2,1-4H3,(H,17,23)
InChIKeyFTQRZCOWAJDHPJ-UHFFFAOYSA-N
XLogP0.15
TPSA111.47 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.37
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-[(5-benzyl-7-methyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide
CID 146068458
N-[(5-benzyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide
CID 146068482
2,6-dimethoxy-N-[[5-methyl-4-(4-methylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]methyl]pyridine-3-carboxamide
CID 53195450
methyl 2-[(2R,5S)-5-[[(2,6-dimethoxypyridine-3-carbonyl)amino]methyl]-1-methylpyrrolidin-2-yl]acetate
CID 165425398
2,6-dimethoxy-N-(naphthalen-1-ylmethyl)pyridine-3-carboxamide
CID 20969022
2,6-dimethoxy-N-(oxan-4-ylmethyl)pyridine-3-carboxamide
CID 91914773
6-methoxy-N-[(7-methyl-6-oxo-5,7-dihydro-4H-triazolo[1,5-a]pyrazin-3-yl)methyl]-1H-indole-2-carboxamide
CID 146065842
2,6-dimethoxy-N-[3-(triazol-1-yl)propyl]pyridine-3-carboxamide
CID 91768013
2-(3-methoxyphenyl)-N-[(7-methyl-6-oxo-5,7-dihydro-4H-triazolo[1,5-a]pyrazin-3-yl)methyl]acetamide
CID 146068217
N-[(2,6-dimethoxy-3-pyridinyl)methyl]-2-(2-oxopyrrolidin-1-yl)benzamide
CID 139004492
2,6-dimethoxy-N-[(1-methyl-6-oxo-4-pyrimidin-4-ylpyrimidin-2-yl)methyl]pyridine-3-carboxamide
CID 68532318
4-(2,6-dimethoxypyridine-3-carbonyl)-3-methyl-1-(2-methylpropyl)piperazin-2-one
CID 70706978

Frequently Asked Questions

What is the IUPAC name of N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide?
The IUPAC name of N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide (CID 146068380) is N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide.
What is the SMILES notation for N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide?
The canonical SMILES for N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide is COc1ccc(C(=O)NCc2nnn3c2CN(C)C(=O)C3C)c(OC)n1.
What is the InChIKey of N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide?
The InChIKey is FTQRZCOWAJDHPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O4/c1-9-16(24)21(2)8-12-11(19-20-22(9)12)7-17-14(23)10-5-6-13(25-3)18-15(10)26-4/h5-6,9H,7-8H2,1-4H3,(H,17,23).
What are the key properties of N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide?
N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide has a molecular weight of 360.37 g/mol, XLogP of 0.15, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5,7-dimethyl-6-oxo-4,7-dihydrotriazolo[1,5-a]pyrazin-3-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide is sourced from PubChem (CID 146068380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).