N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide

C19H25N3O2 — CID 24641089

IUPACN-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc2[nH]c3c(c2c1)CCCC3
InChIInChI=1S/C19H25N3O2/c23-19(20-7-8-22-9-11-24-12-10-22)14-5-6-18-16(13-14)15-3-1-2-4-17(15)21-18/h5-6,13,21H,1-4,7-12H2,(H,20,23)
InChIKeyWLKAPEYDFZGJIO-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.11
Rot. Bonds4

About N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide

N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide (PubChem CID 24641089) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
PubChem CID24641089
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc2[nH]c3c(c2c1)CCCC3
InChIInChI=1S/C19H25N3O2/c23-19(20-7-8-22-9-11-24-12-10-22)14-5-6-18-16(13-14)15-3-1-2-4-17(15)21-18/h5-6,13,21H,1-4,7-12H2,(H,20,23)
InChIKeyWLKAPEYDFZGJIO-UHFFFAOYSA-N
XLogP2.11
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide (CID 24641089) is N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide is O=C(NCCN1CCOCC1)c1ccc2[nH]c3c(c2c1)CCCC3.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The InChIKey is WLKAPEYDFZGJIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c23-19(20-7-8-22-9-11-24-12-10-22)14-5-6-18-16(13-14)15-3-1-2-4-17(15)21-18/h5-6,13,21H,1-4,7-12H2,(H,20,23).
What are the key properties of N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide is sourced from PubChem (CID 24641089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).