N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide

C14H15N3O3S — CID 119045405

IUPACN-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide
SMILESCCN(c1ccc2[nH]ccc2c1)S(=O)(=O)Cc1ccon1
InChIInChI=1S/C14H15N3O3S/c1-2-17(21(18,19)10-12-6-8-20-16-12)13-3-4-14-11(9-13)5-7-15-14/h3-9,15H,2,10H2,1H3
InChIKeyMGDPTPKHODXMIH-UHFFFAOYSA-N
MW305.36 g/mol
LogP2.51
Rot. Bonds5

About N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide

N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide (PubChem CID 119045405) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide
PubChem CID119045405
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC NameN-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide
SMILESCCN(c1ccc2[nH]ccc2c1)S(=O)(=O)Cc1ccon1
InChIInChI=1S/C14H15N3O3S/c1-2-17(21(18,19)10-12-6-8-20-16-12)13-3-4-14-11(9-13)5-7-15-14/h3-9,15H,2,10H2,1H3
InChIKeyMGDPTPKHODXMIH-UHFFFAOYSA-N
XLogP2.51
TPSA79.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide?
The IUPAC name of N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide (CID 119045405) is N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide.
What is the SMILES notation for N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide?
The canonical SMILES for N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide is CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)Cc1ccon1.
What is the InChIKey of N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide?
The InChIKey is MGDPTPKHODXMIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-2-17(21(18,19)10-12-6-8-20-16-12)13-3-4-14-11(9-13)5-7-15-14/h3-9,15H,2,10H2,1H3.
What are the key properties of N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide?
N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide has a molecular weight of 305.36 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(1H-indol-5-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide is sourced from PubChem (CID 119045405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).