(4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone

C15H17N3O — CID 51210665

IUPAC(4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone
SMILESO=C(c1ccc[nH]1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C15H17N3O/c19-15(14-7-4-8-16-14)18-11-9-17(10-12-18)13-5-2-1-3-6-13/h1-8,16H,9-12H2
InChIKeyOICPROFNJBYILR-UHFFFAOYSA-N
MW255.32 g/mol
LogP1.98
Rot. Bonds2

About (4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone

(4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone (PubChem CID 51210665) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is (4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone.

Molecular Properties

Compound Name(4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone
PubChem CID51210665
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name(4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone
SMILESO=C(c1ccc[nH]1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C15H17N3O/c19-15(14-7-4-8-16-14)18-11-9-17(10-12-18)13-5-2-1-3-6-13/h1-8,16H,9-12H2
InChIKeyOICPROFNJBYILR-UHFFFAOYSA-N
XLogP1.98
TPSA39.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone 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-(4-methoxyphenyl)piperazin-1-yl]-(1H-pyrrol-2-yl)methanone
CID 51211150
3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one
CID 25333485
bis[4-(4-phenylpiperazine-1-carbonyl)phenyl]methanone
CID 86192907
4-(1H-pyrrole-2-carbonyl)piperazine-1-sulfonamide
CID 61128995
(4-ethylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone
CID 110690985
2-[4-(1H-pyrrole-2-carbonyl)piperazin-1-yl]propanoic acid
CID 62317771
4-[4-(1H-pyrrole-2-carbonyl)piperazin-1-yl]-2-pyrrolidin-1-ylbenzamide
CID 166792144
5-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one
CID 4826168
1H-pyrrol-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone
CID 110801970
1H-pyrrol-2-yl-[4-(2-sulfanylethyl)piperazin-1-yl]methanone
CID 115273300
(4-phenylpiperazin-1-yl)-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone
CID 46652337
3,3-dimethyl-1-[4-(1H-pyrrole-2-carbonyl)piperazin-1-yl]butan-1-one
CID 110803998

Frequently Asked Questions

What is the IUPAC name of (4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone?
The IUPAC name of (4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone (CID 51210665) is (4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone.
What is the SMILES notation for (4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone?
The canonical SMILES for (4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone is O=C(c1ccc[nH]1)N1CCN(c2ccccc2)CC1.
What is the InChIKey of (4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone?
The InChIKey is OICPROFNJBYILR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c19-15(14-7-4-8-16-14)18-11-9-17(10-12-18)13-5-2-1-3-6-13/h1-8,16H,9-12H2.
What are the key properties of (4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone?
(4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone has a molecular weight of 255.32 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone is sourced from PubChem (CID 51210665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).