5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide

C16H15N3O2 — CID 166285106

IUPAC5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide
SMILESCN(C(=O)c1cc(C2CC2)on1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H15N3O2/c1-19(12-4-5-13-11(8-12)6-7-17-13)16(20)14-9-15(21-18-14)10-2-3-10/h4-10,17H,2-3H2,1H3
InChIKeyTYZKZGBUOKDPQZ-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.31
Rot. Bonds3

About 5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide

5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide (PubChem CID 166285106) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is 5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide
PubChem CID166285106
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC Name5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide
SMILESCN(C(=O)c1cc(C2CC2)on1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H15N3O2/c1-19(12-4-5-13-11(8-12)6-7-17-13)16(20)14-9-15(21-18-14)10-2-3-10/h4-10,17H,2-3H2,1H3
InChIKeyTYZKZGBUOKDPQZ-UHFFFAOYSA-N
XLogP3.31
TPSA62.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide (CID 166285106) is 5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide is CN(C(=O)c1cc(C2CC2)on1)c1ccc2[nH]ccc2c1.
What is the InChIKey of 5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is TYZKZGBUOKDPQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-19(12-4-5-13-11(8-12)6-7-17-13)16(20)14-9-15(21-18-14)10-2-3-10/h4-10,17H,2-3H2,1H3.
What are the key properties of 5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide?
5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 281.31 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 166285106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).