N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide

C17H19N3O2 — CID 56758140

IUPACN-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide
SMILESCCc1cc(CN(C)C(=O)c2cc3ccccc3n2C)on1
InChIInChI=1S/C17H19N3O2/c1-4-13-10-14(22-18-13)11-19(2)17(21)16-9-12-7-5-6-8-15(12)20(16)3/h5-10H,4,11H2,1-3H3
InChIKeyJABWPIWLHHXNRZ-UHFFFAOYSA-N
MW297.36 g/mol
LogP3.00
Rot. Bonds4

About N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide

N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide (PubChem CID 56758140) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide.

Molecular Properties

Compound NameN-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide
PubChem CID56758140
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide
SMILESCCc1cc(CN(C)C(=O)c2cc3ccccc3n2C)on1
InChIInChI=1S/C17H19N3O2/c1-4-13-10-14(22-18-13)11-19(2)17(21)16-9-12-7-5-6-8-15(12)20(16)3/h5-10H,4,11H2,1-3H3
InChIKeyJABWPIWLHHXNRZ-UHFFFAOYSA-N
XLogP3.00
TPSA51.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-{[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl}-N-[1-(propan-2-yl)piperidin-4-yl]-1H-indole-2-carboxamide
CID 20801030
5-(carbazol-9-ylmethyl)-N-[[4-(hydroxycarbamoyl)phenyl]methyl]-1,2-oxazole-3-carboxamide
CID 126649181
N-(3-methyl-1,2-oxazol-5-yl)-1-oxo-2,3,4,5-tetrahydro-[1,4]diazepino[1,2-a]indole-8-carboxamide
CID 56835180
1-oxo-N-(3-propan-2-yl-1,2-oxazol-5-yl)-2,3,4,5-tetrahydro-[1,4]diazepino[1,2-a]indole-8-carboxamide
CID 57400465
N-(3-methyl-1,2-oxazol-5-yl)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]indol-3-yl]-2-oxoacetamide
CID 10970526
2-[3-[3-(3,5-Dimethyl-1,2-oxazol-4-yl)phenyl]-5-fluoro-2-methylindol-1-yl]acetic acid
CID 118715191
N-(9-Ethyl-9H-carbazol-3-yl)-5-methylisoxazole-3-carboxamide
CID 2461257
4,4-dimethyl-1-oxo-N-(3-phenyl-1,2-oxazol-5-yl)-2,3-dihydropyrazino[1,2-a]indole-7-carboxamide
CID 53247557
N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-1-oxo-2,3,4,5-tetrahydro-[1,4]diazepino[1,2-a]indole-8-carboxamide
CID 68323380
1-oxo-N-(3-propyl-1,2-oxazol-5-yl)-2,3,4,5-tetrahydro-[1,4]diazepino[1,2-a]indole-8-carboxamide
CID 68323403
N-(3-tert-butyl-1,2-oxazol-5-yl)-1-oxo-2,3,4,5-tetrahydro-[1,4]diazepino[1,2-a]indole-8-carboxamide
CID 89523686
3-N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-N-[(1R)-1-phenylpropyl]-5,6,7,8-tetrahydroindolizine-1,3-dicarboxamide
CID 89726880

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide?
The IUPAC name of N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide (CID 56758140) is N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide.
What is the SMILES notation for N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide?
The canonical SMILES for N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide is CCc1cc(CN(C)C(=O)c2cc3ccccc3n2C)on1.
What is the InChIKey of N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide?
The InChIKey is JABWPIWLHHXNRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-4-13-10-14(22-18-13)11-19(2)17(21)16-9-12-7-5-6-8-15(12)20(16)3/h5-10H,4,11H2,1-3H3.
What are the key properties of N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide?
N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide has a molecular weight of 297.36 g/mol, XLogP of 3.00, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide is sourced from PubChem (CID 56758140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).