6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide

C19H24N2O3 — CID 51130596

IUPAC6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide
SMILESCC1CCc2[nH]c3c(C(=O)NOC4CCCCO4)cccc3c2C1
InChIInChI=1S/C19H24N2O3/c1-12-8-9-16-15(11-12)13-5-4-6-14(18(13)20-16)19(22)21-24-17-7-2-3-10-23-17/h4-6,12,17,20H,2-3,7-11H2,1H3,(H,21,22)
InChIKeyWWRMDWUWBNGPQN-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.48
Rot. Bonds3

About 6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide

6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide (PubChem CID 51130596) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide
PubChem CID51130596
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide
SMILESCC1CCc2[nH]c3c(C(=O)NOC4CCCCO4)cccc3c2C1
InChIInChI=1S/C19H24N2O3/c1-12-8-9-16-15(11-12)13-5-4-6-14(18(13)20-16)19(22)21-24-17-7-2-3-10-23-17/h4-6,12,17,20H,2-3,7-11H2,1H3,(H,21,22)
InChIKeyWWRMDWUWBNGPQN-UHFFFAOYSA-N
XLogP3.48
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide 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-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide?
The IUPAC name of 6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide (CID 51130596) is 6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide.
What is the SMILES notation for 6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide?
The canonical SMILES for 6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide is CC1CCc2[nH]c3c(C(=O)NOC4CCCCO4)cccc3c2C1.
What is the InChIKey of 6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide?
The InChIKey is WWRMDWUWBNGPQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-12-8-9-16-15(11-12)13-5-4-6-14(18(13)20-16)19(22)21-24-17-7-2-3-10-23-17/h4-6,12,17,20H,2-3,7-11H2,1H3,(H,21,22).
What are the key properties of 6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide?
6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide has a molecular weight of 328.41 g/mol, XLogP of 3.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(oxan-2-yloxy)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide is sourced from PubChem (CID 51130596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).