N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide

C22H23N3O — CID 86566487

IUPACN-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide
SMILESCN(C)CCCNC(=O)c1cc2[nH]c3ccccc3c2c2ccccc12
InChIInChI=1S/C22H23N3O/c1-25(2)13-7-12-23-22(26)18-14-20-21(16-9-4-3-8-15(16)18)17-10-5-6-11-19(17)24-20/h3-6,8-11,14,24H,7,12-13H2,1-2H3,(H,23,26)
InChIKeyJMYMXCDQJJTJMJ-UHFFFAOYSA-N
MW345.45 g/mol
LogP4.16
Rot. Bonds5

About N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide

N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide (PubChem CID 86566487) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide
PubChem CID86566487
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC NameN-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide
SMILESCN(C)CCCNC(=O)c1cc2[nH]c3ccccc3c2c2ccccc12
InChIInChI=1S/C22H23N3O/c1-25(2)13-7-12-23-22(26)18-14-20-21(16-9-4-3-8-15(16)18)17-10-5-6-11-19(17)24-20/h3-6,8-11,14,24H,7,12-13H2,1-2H3,(H,23,26)
InChIKeyJMYMXCDQJJTJMJ-UHFFFAOYSA-N
XLogP4.16
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[3-(dimethylamino)propyl]-2-oxo-1H-quinoline-4-carboxamide
CID 110694434
N-[3-(dimethylamino)propyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
CID 110701163
1-[2-(dimethylamino)ethylamino]-N-[3-[[1-[2-(dimethylamino)ethylamino]-9-oxo-10H-acridine-4-carbonyl]amino]propyl]-9-oxo-10H-acridine-4-carboxamide
CID 11814469
methyl 4-[(2-oxo-1H-quinoline-4-carbonyl)amino]butanoate
CID 29131557
N-[3-(dimethylamino)propyl]-1-hydrazinylisoquinoline-4-carboxamide
CID 106773595
2-benzoyl-N-[3-(dimethylamino)propyl]benzamide
CID 78793921
4-amino-N-[2-(dimethylamino)ethyl]naphthalene-1-carboxamide
CID 164662948
1-acetyl-N-[3-(dimethylamino)propyl]indole-3-carboxamide
CID 113207837
N-[3-(dimethylamino)propyl]-7-fluoro-9-oxo-10H-acridine-2-carboxamide
CID 86802615
ethyl 4-[(2-oxo-1H-quinoline-4-carbonyl)amino]butanoate
CID 37262146
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-2-oxo-1H-quinoline-4-carboxamide
CID 26447386
N-[3-(dimethylamino)propyl]-2,4,5-trimethylbenzamide
CID 95970652

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide (CID 86566487) is N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide is CN(C)CCCNC(=O)c1cc2[nH]c3ccccc3c2c2ccccc12.
What is the InChIKey of N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide?
The InChIKey is JMYMXCDQJJTJMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O/c1-25(2)13-7-12-23-22(26)18-14-20-21(16-9-4-3-8-15(16)18)17-10-5-6-11-19(17)24-20/h3-6,8-11,14,24H,7,12-13H2,1-2H3,(H,23,26).
What are the key properties of N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide?
N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide has a molecular weight of 345.45 g/mol, XLogP of 4.16, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-7H-benzo[c]carbazole-5-carboxamide is sourced from PubChem (CID 86566487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).