N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide

C14H14N4O3 — CID 2810772

IUPACN-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCOc1cccc2c1c(NC(=O)c1cc(C)on1)nn2C
InChIInChI=1S/C14H14N4O3/c1-8-7-9(17-21-8)14(19)15-13-12-10(18(2)16-13)5-4-6-11(12)20-3/h4-7H,1-3H3,(H,15,16,19)
InChIKeyGTEAZTRHXKDTBC-UHFFFAOYSA-N
MW286.29 g/mol
LogP2.13
Rot. Bonds3

About N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide

N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide (PubChem CID 2810772) has the molecular formula C14H14N4O3 and a molecular weight of 286.29 g/mol. Its IUPAC name is N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide
PubChem CID2810772
Molecular FormulaC14H14N4O3
Molecular Weight286.29 g/mol
Exact Mass286.11
IUPAC NameN-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCOc1cccc2c1c(NC(=O)c1cc(C)on1)nn2C
InChIInChI=1S/C14H14N4O3/c1-8-7-9(17-21-8)14(19)15-13-12-10(18(2)16-13)5-4-6-11(12)20-3/h4-7H,1-3H3,(H,15,16,19)
InChIKeyGTEAZTRHXKDTBC-UHFFFAOYSA-N
XLogP2.13
TPSA82.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide (CID 2810772) is N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide is COc1cccc2c1c(NC(=O)c1cc(C)on1)nn2C.
What is the InChIKey of N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is GTEAZTRHXKDTBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O3/c1-8-7-9(17-21-8)14(19)15-13-12-10(18(2)16-13)5-4-6-11(12)20-3/h4-7H,1-3H3,(H,15,16,19).
What are the key properties of N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide?
N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 286.29 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-1-methylindazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 2810772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).