N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide

C23H23N7O3 — CID 176594560

IUPACN-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide
SMILESCOc1ccc(C2CCON2C(=O)Nc2cc(-c3ccc4nc(N)nn4c3)cnc2C)cc1
InChIInChI=1S/C23H23N7O3/c1-14-19(11-17(12-25-14)16-5-8-21-27-22(24)28-29(21)13-16)26-23(31)30-20(9-10-33-30)15-3-6-18(32-2)7-4-15/h3-8,11-13,20H,9-10H2,1-2H3,(H2,24,28)(H,26,31)
InChIKeyZKPFCWMVPZVJHS-UHFFFAOYSA-N
MW445.48 g/mol
LogP3.60
Rot. Bonds4

About N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide

N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide (PubChem CID 176594560) has the molecular formula C23H23N7O3 and a molecular weight of 445.48 g/mol. Its IUPAC name is N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide.

Molecular Properties

Compound NameN-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide
PubChem CID176594560
Molecular FormulaC23H23N7O3
Molecular Weight445.48 g/mol
Exact Mass445.19
IUPAC NameN-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide
SMILESCOc1ccc(C2CCON2C(=O)Nc2cc(-c3ccc4nc(N)nn4c3)cnc2C)cc1
InChIInChI=1S/C23H23N7O3/c1-14-19(11-17(12-25-14)16-5-8-21-27-22(24)28-29(21)13-16)26-23(31)30-20(9-10-33-30)15-3-6-18(32-2)7-4-15/h3-8,11-13,20H,9-10H2,1-2H3,(H2,24,28)(H,26,31)
InChIKeyZKPFCWMVPZVJHS-UHFFFAOYSA-N
XLogP3.60
TPSA119.90 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500445.48
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide with MolForge

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Related Compounds

(3S)-N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methylphenyl]-3-(4-methylphenyl)-1,2-oxazolidine-2-carboxamide
CID 176594482
N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methoxyphenyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
CID 176594506
N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
CID 176594538
N-[5-(2-amino-1,3-benzoxazol-6-yl)-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
CID 176594517
N-[5-(2-acetamido-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
CID 176594547
N-[5-[2-[[(1S,2S)-2-fluorocyclopropanecarbonyl]amino]imidazo[1,2-b]pyridazin-6-yl]-2-methylphenyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
CID 176594458
N-[5-[4-amino-5-(trifluoromethyl)pyrrolo[2,1-f][1,2,4]triazin-7-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
CID 176594505
N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methylphenyl]-3-(4-fluorophenyl)oxazine-2-carboxamide
CID 170171049
(3S)-3-(5-fluoro-6-methyl-3-pyridinyl)-1,2-oxazolidine-2-carboxylic acid
CID 129188798
N,3-diphenyl-1,2-oxazolidine-2-carboxamide
CID 154595659
6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine
CID 82555763
6-(2-phenoxypyrimidin-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 162507407

Frequently Asked Questions

What is the IUPAC name of N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide?
The IUPAC name of N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide (CID 176594560) is N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide.
What is the SMILES notation for N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide?
The canonical SMILES for N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide is COc1ccc(C2CCON2C(=O)Nc2cc(-c3ccc4nc(N)nn4c3)cnc2C)cc1.
What is the InChIKey of N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide?
The InChIKey is ZKPFCWMVPZVJHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N7O3/c1-14-19(11-17(12-25-14)16-5-8-21-27-22(24)28-29(21)13-16)26-23(31)30-20(9-10-33-30)15-3-6-18(32-2)7-4-15/h3-8,11-13,20H,9-10H2,1-2H3,(H2,24,28)(H,26,31).
What are the key properties of N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide?
N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide has a molecular weight of 445.48 g/mol, XLogP of 3.60, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide is sourced from PubChem (CID 176594560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).