N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide

C19H25N3O2 — CID 119739199

IUPACN,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
SMILESC=CCN(CC=C)C(=O)c1ccc(NC(=O)CC2CCCN2)cc1
InChIInChI=1S/C19H25N3O2/c1-3-12-22(13-4-2)19(24)15-7-9-16(10-8-15)21-18(23)14-17-6-5-11-20-17/h3-4,7-10,17,20H,1-2,5-6,11-14H2,(H,21,23)
InChIKeyWBLIIYRUQAGZOF-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.58
Rot. Bonds8

About N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide

N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide (PubChem CID 119739199) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
PubChem CID119739199
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
SMILESC=CCN(CC=C)C(=O)c1ccc(NC(=O)CC2CCCN2)cc1
InChIInChI=1S/C19H25N3O2/c1-3-12-22(13-4-2)19(24)15-7-9-16(10-8-15)21-18(23)14-17-6-5-11-20-17/h3-4,7-10,17,20H,1-2,5-6,11-14H2,(H,21,23)
InChIKeyWBLIIYRUQAGZOF-UHFFFAOYSA-N
XLogP2.58
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide 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-(4-acetamidophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119669050
N-phenyl-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
CID 119756453
N-(4-chlorophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119671239
N-propan-2-yl-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide;hydrochloride
CID 119740098
2-[4-[(2-pyrrolidin-2-ylacetyl)amino]phenyl]acetic acid
CID 61366052
methyl 2-[[4-[(2-pyrrolidin-2-ylacetyl)amino]benzoyl]amino]acetate;hydrochloride
CID 119692977
4-(3-piperidin-3-ylbutanoylamino)-N,N-bis(prop-2-enyl)benzamide;hydrochloride
CID 119739180
N-(3,4-dimethylphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119670651
N-(4-pentylphenyl)-2-pyrrolidin-2-ylacetamide
CID 61363717
N-[4-[2-(dimethylamino)-2-oxoethyl]phenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119719041
2-pyrrolidin-2-yl-N-[4-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 61365999
N-(4-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119670724

Frequently Asked Questions

What is the IUPAC name of N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide?
The IUPAC name of N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide (CID 119739199) is N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide.
What is the SMILES notation for N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide?
The canonical SMILES for N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide is C=CCN(CC=C)C(=O)c1ccc(NC(=O)CC2CCCN2)cc1.
What is the InChIKey of N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide?
The InChIKey is WBLIIYRUQAGZOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-3-12-22(13-4-2)19(24)15-7-9-16(10-8-15)21-18(23)14-17-6-5-11-20-17/h3-4,7-10,17,20H,1-2,5-6,11-14H2,(H,21,23).
What are the key properties of N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide?
N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide has a molecular weight of 327.43 g/mol, XLogP of 2.58, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(prop-2-enyl)-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide is sourced from PubChem (CID 119739199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).