7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide

C23H21N3O2 — CID 66605359

IUPAC7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide
SMILESNC(=O)c1cc(-c2ccccc2)cc2c1[nH]c1cc(N3CCOCC3)ccc12
InChIInChI=1S/C23H21N3O2/c24-23(27)20-13-16(15-4-2-1-3-5-15)12-19-18-7-6-17(14-21(18)25-22(19)20)26-8-10-28-11-9-26/h1-7,12-14,25H,8-11H2,(H2,24,27)
InChIKeyBYVPYKQVELSVBA-UHFFFAOYSA-N
MW371.44 g/mol
LogP3.92
Rot. Bonds3

About 7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide

7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide (PubChem CID 66605359) has the molecular formula C23H21N3O2 and a molecular weight of 371.44 g/mol. Its IUPAC name is 7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide.

Molecular Properties

Compound Name7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide
PubChem CID66605359
Molecular FormulaC23H21N3O2
Molecular Weight371.44 g/mol
Exact Mass371.16
IUPAC Name7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide
SMILESNC(=O)c1cc(-c2ccccc2)cc2c1[nH]c1cc(N3CCOCC3)ccc12
InChIInChI=1S/C23H21N3O2/c24-23(27)20-13-16(15-4-2-1-3-5-15)12-19-18-7-6-17(14-21(18)25-22(19)20)26-8-10-28-11-9-26/h1-7,12-14,25H,8-11H2,(H2,24,27)
InChIKeyBYVPYKQVELSVBA-UHFFFAOYSA-N
XLogP3.92
TPSA71.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide?
The IUPAC name of 7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide (CID 66605359) is 7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide.
What is the SMILES notation for 7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide?
The canonical SMILES for 7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide is NC(=O)c1cc(-c2ccccc2)cc2c1[nH]c1cc(N3CCOCC3)ccc12.
What is the InChIKey of 7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide?
The InChIKey is BYVPYKQVELSVBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O2/c24-23(27)20-13-16(15-4-2-1-3-5-15)12-19-18-7-6-17(14-21(18)25-22(19)20)26-8-10-28-11-9-26/h1-7,12-14,25H,8-11H2,(H2,24,27).
What are the key properties of 7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide?
7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide has a molecular weight of 371.44 g/mol, XLogP of 3.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-morpholin-4-yl-3-phenyl-9H-carbazole-1-carboxamide is sourced from PubChem (CID 66605359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).