2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide

C17H26N4O3 — CID 51242554

IUPAC2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide
SMILESCC(C)NC(=O)NC(=O)C(C)N1CCN(c2ccc(O)cc2)CC1
InChIInChI=1S/C17H26N4O3/c1-12(2)18-17(24)19-16(23)13(3)20-8-10-21(11-9-20)14-4-6-15(22)7-5-14/h4-7,12-13,22H,8-11H2,1-3H3,(H2,18,19,23,24)
InChIKeyATMISVQAHALPIY-UHFFFAOYSA-N
MW334.42 g/mol
LogP1.14
Rot. Bonds4

About 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide

2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide (PubChem CID 51242554) has the molecular formula C17H26N4O3 and a molecular weight of 334.42 g/mol. Its IUPAC name is 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide
PubChem CID51242554
Molecular FormulaC17H26N4O3
Molecular Weight334.42 g/mol
Exact Mass334.20
IUPAC Name2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide
SMILESCC(C)NC(=O)NC(=O)C(C)N1CCN(c2ccc(O)cc2)CC1
InChIInChI=1S/C17H26N4O3/c1-12(2)18-17(24)19-16(23)13(3)20-8-10-21(11-9-20)14-4-6-15(22)7-5-14/h4-7,12-13,22H,8-11H2,1-3H3,(H2,18,19,23,24)
InChIKeyATMISVQAHALPIY-UHFFFAOYSA-N
XLogP1.14
TPSA84.91 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide 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

2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(methylcarbamoyl)propanamide
CID 46800721
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-propan-2-ylpropanamide
CID 46744278
(2S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-N-(methylcarbamoyl)propanamide
CID 8703867
(2S)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-phenylpropanamide
CID 40729619
(2S)-N-(4-bromophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]propanamide
CID 2096677
N-(4-bromophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]propanamide
CID 4264771
(2S)-N-(3,5-dichlorophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]propanamide
CID 2096596
N-(2-chlorophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]propanamide
CID 46630893
(2R)-N-(2-acetylphenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]propanamide
CID 9276896
(2R)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(2,4,5-trichlorophenyl)propanamide
CID 41038243
(2S)-N-(cyclopentylcarbamoyl)-2-(4-phenylpiperazin-1-yl)propanamide
CID 9250310
(2S)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide
CID 9430472

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide?
The IUPAC name of 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide (CID 51242554) is 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide.
What is the SMILES notation for 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide?
The canonical SMILES for 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide is CC(C)NC(=O)NC(=O)C(C)N1CCN(c2ccc(O)cc2)CC1.
What is the InChIKey of 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide?
The InChIKey is ATMISVQAHALPIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O3/c1-12(2)18-17(24)19-16(23)13(3)20-8-10-21(11-9-20)14-4-6-15(22)7-5-14/h4-7,12-13,22H,8-11H2,1-3H3,(H2,18,19,23,24).
What are the key properties of 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide?
2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide has a molecular weight of 334.42 g/mol, XLogP of 1.14, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)propanamide is sourced from PubChem (CID 51242554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).