N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide

C17H18N4O3 — CID 49354389

IUPACN-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
SMILESCOc1c(C)cnc(CNC(=O)c2cnc3onc(C)c3c2)c1C
InChIInChI=1S/C17H18N4O3/c1-9-6-18-14(10(2)15(9)23-4)8-19-16(22)12-5-13-11(3)21-24-17(13)20-7-12/h5-7H,8H2,1-4H3,(H,19,22)
InChIKeyJGGANUMOZVJEPK-UHFFFAOYSA-N
MW326.36 g/mol
LogP2.48
Rot. Bonds4

About N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide

N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide (PubChem CID 49354389) has the molecular formula C17H18N4O3 and a molecular weight of 326.36 g/mol. Its IUPAC name is N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
PubChem CID49354389
Molecular FormulaC17H18N4O3
Molecular Weight326.36 g/mol
Exact Mass326.14
IUPAC NameN-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
SMILESCOc1c(C)cnc(CNC(=O)c2cnc3onc(C)c3c2)c1C
InChIInChI=1S/C17H18N4O3/c1-9-6-18-14(10(2)15(9)23-4)8-19-16(22)12-5-13-11(3)21-24-17(13)20-7-12/h5-7H,8H2,1-4H3,(H,19,22)
InChIKeyJGGANUMOZVJEPK-UHFFFAOYSA-N
XLogP2.48
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide with MolForge

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Related Compounds

4-[(4-Methoxy-benzenesulfonyl)-pyridin-3-ylmethyl-amino]-3-methyl-isoxazolo[5,4-b]pyridine-5-carboxylic acid hydroxyamide
CID 10116042
N-[(5,6-dimethoxy-2-pyridinyl)methyl]-6-(5-methyl-3-pyridinyl)-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 71555054
N,N,3-trimethyl-4-[3-[4-[2-(2,2,2-trifluoroethoxy)phenyl]piperazin-1-yl]propylamino]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 10839699
N-Isopropyl-6-(5-methyl-3-pyridin-4-yl-isoxazol-4-ylmethoxy)-nicotinamide
CID 68443974
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3,6-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 49353846
(3-Methyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 51076263
3-methyl-N-(oxan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 51089828
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 51095249
3-methyl-N-(oxolan-2-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 53497809
N-cyclopropyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 53497816
N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 53497826
3-methyl-N-(oxolan-3-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 53497975

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The IUPAC name of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide (CID 49354389) is N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide.
What is the SMILES notation for N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The canonical SMILES for N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide is COc1c(C)cnc(CNC(=O)c2cnc3onc(C)c3c2)c1C.
What is the InChIKey of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The InChIKey is JGGANUMOZVJEPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3/c1-9-6-18-14(10(2)15(9)23-4)8-19-16(22)12-5-13-11(3)21-24-17(13)20-7-12/h5-7H,8H2,1-4H3,(H,19,22).
What are the key properties of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide has a molecular weight of 326.36 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 49354389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).