4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide

C23H26N4O — CID 45136832

IUPAC4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide
SMILESO=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc2ncccc2c1
InChIInChI=1S/C23H26N4O/c28-23(25-20-10-11-22-19(18-20)6-4-12-24-22)9-5-13-26-14-16-27(17-15-26)21-7-2-1-3-8-21/h1-4,6-8,10-12,18H,5,9,13-17H2,(H,25,28)
InChIKeyULAGLIIMCOUZAD-UHFFFAOYSA-N
MW374.49 g/mol
LogP3.78
Rot. Bonds6

About 4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide

4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide (PubChem CID 45136832) has the molecular formula C23H26N4O and a molecular weight of 374.49 g/mol. Its IUPAC name is 4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide.

Molecular Properties

Compound Name4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide
PubChem CID45136832
Molecular FormulaC23H26N4O
Molecular Weight374.49 g/mol
Exact Mass374.21
IUPAC Name4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide
SMILESO=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc2ncccc2c1
InChIInChI=1S/C23H26N4O/c28-23(25-20-10-11-22-19(18-20)6-4-12-24-22)9-5-13-26-14-16-27(17-15-26)21-7-2-1-3-8-21/h1-4,6-8,10-12,18H,5,9,13-17H2,(H,25,28)
InChIKeyULAGLIIMCOUZAD-UHFFFAOYSA-N
XLogP3.78
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide 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

(E)-but-2-enedioic acid;N-methyl-5-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylpentanamide
CID 67095660
5-chloro-N-quinolin-6-ylpentanamide
CID 55097309
4-(4-phenylpiperazin-1-yl)-N-(3,4,5-trichlorophenyl)butanamide
CID 25169359
N-quinolin-3-yl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pentanamide
CID 162787974
5-[4-(3-cyanophenyl)piperazin-1-yl]-N-quinolin-3-ylpentanamide
CID 162787940
N,N'-di(quinolin-6-yl)propanediamide
CID 2837594
4-(4-methoxybutyl)-N-quinolin-6-ylpiperazine-1-carboxamide
CID 72885784
4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-quinolin-6-ylbutanamide
CID 78887675
2-chloro-N-quinolin-6-ylacetamide
CID 3144388
N-(4-methylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride
CID 19661863
N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride
CID 19661841
N-quinolin-6-ylbenzamide
CID 833617

Frequently Asked Questions

What is the IUPAC name of 4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide?
The IUPAC name of 4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide (CID 45136832) is 4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide.
What is the SMILES notation for 4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide?
The canonical SMILES for 4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide is O=C(CCCN1CCN(c2ccccc2)CC1)Nc1ccc2ncccc2c1.
What is the InChIKey of 4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide?
The InChIKey is ULAGLIIMCOUZAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O/c28-23(25-20-10-11-22-19(18-20)6-4-12-24-22)9-5-13-26-14-16-27(17-15-26)21-7-2-1-3-8-21/h1-4,6-8,10-12,18H,5,9,13-17H2,(H,25,28).
What are the key properties of 4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide?
4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide has a molecular weight of 374.49 g/mol, XLogP of 3.78, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-phenylpiperazin-1-yl)-N-quinolin-6-ylbutanamide is sourced from PubChem (CID 45136832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).