[6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone

C22H21N3O3 — CID 90375239

IUPAC[6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone
SMILESCc1noc(C)c1-c1ccc2[nH]c3cc(C(=O)N4CCOCC4)ccc3c2c1
InChIInChI=1S/C22H21N3O3/c1-13-21(14(2)28-24-13)15-4-6-19-18(11-15)17-5-3-16(12-20(17)23-19)22(26)25-7-9-27-10-8-25/h3-6,11-12,23H,7-10H2,1-2H3
InChIKeyTYFFMZACRIXZKY-UHFFFAOYSA-N
MW375.43 g/mol
LogP4.07
Rot. Bonds2

About [6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone

[6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone (PubChem CID 90375239) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is [6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone
PubChem CID90375239
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC Name[6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone
SMILESCc1noc(C)c1-c1ccc2[nH]c3cc(C(=O)N4CCOCC4)ccc3c2c1
InChIInChI=1S/C22H21N3O3/c1-13-21(14(2)28-24-13)15-4-6-19-18(11-15)17-5-3-16(12-20(17)23-19)22(26)25-7-9-27-10-8-25/h3-6,11-12,23H,7-10H2,1-2H3
InChIKeyTYFFMZACRIXZKY-UHFFFAOYSA-N
XLogP4.07
TPSA71.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone?
The IUPAC name of [6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone (CID 90375239) is [6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone is Cc1noc(C)c1-c1ccc2[nH]c3cc(C(=O)N4CCOCC4)ccc3c2c1.
What is the InChIKey of [6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone?
The InChIKey is TYFFMZACRIXZKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-13-21(14(2)28-24-13)15-4-6-19-18(11-15)17-5-3-16(12-20(17)23-19)22(26)25-7-9-27-10-8-25/h3-6,11-12,23H,7-10H2,1-2H3.
What are the key properties of [6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone?
[6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone has a molecular weight of 375.43 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 90375239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).