N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide

C14H14N4O2 — CID 166321033

IUPACN-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide
SMILESCc1nc(NC(=O)c2nn(C)c3ccccc23)oc1C
InChIInChI=1S/C14H14N4O2/c1-8-9(2)20-14(15-8)16-13(19)12-10-6-4-5-7-11(10)18(3)17-12/h4-7H,1-3H3,(H,15,16,19)
InChIKeyQMRPHIIZVDJMQC-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.43
Rot. Bonds2

About N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide

N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide (PubChem CID 166321033) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide
PubChem CID166321033
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC NameN-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide
SMILESCc1nc(NC(=O)c2nn(C)c3ccccc23)oc1C
InChIInChI=1S/C14H14N4O2/c1-8-9(2)20-14(15-8)16-13(19)12-10-6-4-5-7-11(10)18(3)17-12/h4-7H,1-3H3,(H,15,16,19)
InChIKeyQMRPHIIZVDJMQC-UHFFFAOYSA-N
XLogP2.43
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide?
The IUPAC name of N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide (CID 166321033) is N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide.
What is the SMILES notation for N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide?
The canonical SMILES for N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide is Cc1nc(NC(=O)c2nn(C)c3ccccc23)oc1C.
What is the InChIKey of N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide?
The InChIKey is QMRPHIIZVDJMQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c1-8-9(2)20-14(15-8)16-13(19)12-10-6-4-5-7-11(10)18(3)17-12/h4-7H,1-3H3,(H,15,16,19).
What are the key properties of N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide?
N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1,3-oxazol-2-yl)-1-methylindazole-3-carboxamide is sourced from PubChem (CID 166321033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).