(2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide

C21H23N3O — CID 142188591

IUPAC(2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide
SMILESC=C/C=C(/C(=O)Nc1ccc2c(c1)c1ccccc1n2CC)N(C)C
InChIInChI=1S/C21H23N3O/c1-5-9-20(23(3)4)21(25)22-15-12-13-19-17(14-15)16-10-7-8-11-18(16)24(19)6-2/h5,7-14H,1,6H2,2-4H3,(H,22,25)/b20-9-
InChIKeyWXDKUQQZSZOCMB-UKWGHVSLSA-N
MW333.44 g/mol
LogP4.38
Rot. Bonds5

About (2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide

(2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide (PubChem CID 142188591) has the molecular formula C21H23N3O and a molecular weight of 333.44 g/mol. Its IUPAC name is (2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide.

Molecular Properties

Compound Name(2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide
PubChem CID142188591
Molecular FormulaC21H23N3O
Molecular Weight333.44 g/mol
Exact Mass333.18
IUPAC Name(2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide
SMILESC=C/C=C(/C(=O)Nc1ccc2c(c1)c1ccccc1n2CC)N(C)C
InChIInChI=1S/C21H23N3O/c1-5-9-20(23(3)4)21(25)22-15-12-13-19-17(14-15)16-10-7-8-11-18(16)24(19)6-2/h5,7-14H,1,6H2,2-4H3,(H,22,25)/b20-9-
InChIKeyWXDKUQQZSZOCMB-UKWGHVSLSA-N
XLogP4.38
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze (2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide 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

trans-(1S,2S)-1-N,2-N-bis(9-ethylcarbazol-3-yl)-3-methylidenecyclopropane-1,2-dicarboxamide
CID 2321929
N-(9-ethylcarbazol-3-yl)-2-sulfanylacetamide
CID 54424608
2-[carbamoyl(methyl)amino]-N-(9-ethylcarbazol-3-yl)acetamide
CID 9400428
(2R)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(9-ethylcarbazol-3-yl)propanamide
CID 40689904
5-[(9-ethylcarbazol-3-yl)amino]-5-oxopentanoic acid
CID 3498432
N'-(anthracen-9-ylmethylideneamino)-N-(9-ethylcarbazol-3-yl)oxamide
CID 3382572
N-(9-ethylcarbazol-3-yl)-4-(methylamino)butanamide
CID 119672985
N-[(1E)-buta-1,3-dienyl]-9-ethylcarbazol-3-amine
CID 144914531
phenyl N-(9-ethylcarbazol-3-yl)carbamate
CID 2182675
N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide
CID 3128405
3-amino-N-(9-ethylcarbazol-3-yl)-3-methylbutanamide
CID 167911197
2-(4-acetamidophenyl)sulfanyl-N-(9-ethylcarbazol-3-yl)acetamide
CID 22776873

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide?
The IUPAC name of (2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide (CID 142188591) is (2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide.
What is the SMILES notation for (2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide?
The canonical SMILES for (2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide is C=C/C=C(/C(=O)Nc1ccc2c(c1)c1ccccc1n2CC)N(C)C.
What is the InChIKey of (2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide?
The InChIKey is WXDKUQQZSZOCMB-UKWGHVSLSA-N. The full InChI is InChI=1S/C21H23N3O/c1-5-9-20(23(3)4)21(25)22-15-12-13-19-17(14-15)16-10-7-8-11-18(16)24(19)6-2/h5,7-14H,1,6H2,2-4H3,(H,22,25)/b20-9-.
What are the key properties of (2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide?
(2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide has a molecular weight of 333.44 g/mol, XLogP of 4.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(dimethylamino)-N-(9-ethylcarbazol-3-yl)penta-2,4-dienamide is sourced from PubChem (CID 142188591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).