4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide

C16H23N3O2 — CID 79209286

IUPAC4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide
SMILESCN(C)CCOc1ccc(NC(=O)C2C=CC(N)C2)cc1
InChIInChI=1S/C16H23N3O2/c1-19(2)9-10-21-15-7-5-14(6-8-15)18-16(20)12-3-4-13(17)11-12/h3-8,12-13H,9-11,17H2,1-2H3,(H,18,20)
InChIKeyHPJPOENWEKQPLQ-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.47
Rot. Bonds6

About 4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide

4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide (PubChem CID 79209286) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide
PubChem CID79209286
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide
SMILESCN(C)CCOc1ccc(NC(=O)C2C=CC(N)C2)cc1
InChIInChI=1S/C16H23N3O2/c1-19(2)9-10-21-15-7-5-14(6-8-15)18-16(20)12-3-4-13(17)11-12/h3-8,12-13H,9-11,17H2,1-2H3,(H,18,20)
InChIKeyHPJPOENWEKQPLQ-UHFFFAOYSA-N
XLogP1.47
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-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

Related Compounds

4-amino-N-(4-ethoxyphenyl)cyclopent-2-ene-1-carboxamide
CID 79211304
4-[(4-aminocyclopent-2-ene-1-carbonyl)amino]-N,N-dimethylbenzamide
CID 79211253
4-amino-N-(3-propoxyphenyl)cyclopent-2-ene-1-carboxamide
CID 79210859
4-amino-N-[2-(4-bromophenoxy)ethyl]-N-methylcyclopent-2-ene-1-carboxamide
CID 79210396
3-(cyclopropylamino)-N-[4-[2-(dimethylamino)ethoxy]phenyl]propanamide
CID 60928327
(2R)-N-[4-[2-(dimethylamino)ethoxy]phenyl]piperidine-2-carboxamide
CID 103813549
N-[4-[2-(dimethylamino)ethoxy]phenyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119844260
N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-methylpyrrolidine-2-carboxamide
CID 102778343
3-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]propanamide
CID 54862434
4-amino-N-[6-(diethylamino)-3-pyridinyl]cyclopent-2-ene-1-carboxamide
CID 79211338
4-amino-N-(3,5-dimethoxyphenyl)cyclopent-2-ene-1-carboxamide
CID 79210585
4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]butanamide
CID 54862447

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide?
The IUPAC name of 4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide (CID 79209286) is 4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide.
What is the SMILES notation for 4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide?
The canonical SMILES for 4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide is CN(C)CCOc1ccc(NC(=O)C2C=CC(N)C2)cc1.
What is the InChIKey of 4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide?
The InChIKey is HPJPOENWEKQPLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-19(2)9-10-21-15-7-5-14(6-8-15)18-16(20)12-3-4-13(17)11-12/h3-8,12-13H,9-11,17H2,1-2H3,(H,18,20).
What are the key properties of 4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide?
4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.47, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]cyclopent-2-ene-1-carboxamide is sourced from PubChem (CID 79209286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).