2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone

C23H26N4O — CID 155161689

IUPAC2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone
SMILESCn1c(N2CCN(C(=O)Cc3ccc(C4CC4)cc3)CC2)nc2ccccc21
InChIInChI=1S/C23H26N4O/c1-25-21-5-3-2-4-20(21)24-23(25)27-14-12-26(13-15-27)22(28)16-17-6-8-18(9-7-17)19-10-11-19/h2-9,19H,10-16H2,1H3
InChIKeyYYYOGBYOYGGHBX-UHFFFAOYSA-N
MW374.49 g/mol
LogP3.34
Rot. Bonds4

About 2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone

2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone (PubChem CID 155161689) has the molecular formula C23H26N4O and a molecular weight of 374.49 g/mol. Its IUPAC name is 2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone
PubChem CID155161689
Molecular FormulaC23H26N4O
Molecular Weight374.49 g/mol
Exact Mass374.21
IUPAC Name2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone
SMILESCn1c(N2CCN(C(=O)Cc3ccc(C4CC4)cc3)CC2)nc2ccccc21
InChIInChI=1S/C23H26N4O/c1-25-21-5-3-2-4-20(21)24-23(25)27-14-12-26(13-15-27)22(28)16-17-6-8-18(9-7-17)19-10-11-19/h2-9,19H,10-16H2,1H3
InChIKeyYYYOGBYOYGGHBX-UHFFFAOYSA-N
XLogP3.34
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone 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-(3,4-diethoxyphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone
CID 46375629
2-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone
CID 71709857
N-benzyl-4-(1-methylbenzimidazol-2-yl)piperazine-1-carboxamide
CID 651770
2-(4-cyclopropylphenyl)-1-[4-(3H-indol-2-yl)piperazin-1-yl]ethanone
CID 164971057
cyclopropyl-[4-(1-methylbenzimidazol-2-yl)-1,4-diazepan-1-yl]methanone
CID 165435392
1-[4-(6-chloropyridazin-3-yl)piperazin-1-yl]-2-(4-cyclopropylphenyl)ethanone
CID 142616895
2-(4-cyclopropylphenyl)-1-[4-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 170984520
2-cyclohexyl-1-[4-(1-ethylbenzimidazol-2-yl)piperazin-1-yl]ethanone
CID 46375593
1-[4-(1,3-benzothiazol-2-yl)-2-methylpiperazin-1-yl]-2-(4-cyclopropylphenyl)ethanone
CID 155161645
1-[4-(3-methylquinoxalin-2-yl)piperazin-1-yl]-2-phenylethanone
CID 108763798
2-(4-cyclopropylphenyl)-1-[4-[4-(methylideneamino)-5-[(Z)-prop-1-enyl]-1,3-thiazol-2-yl]piperazin-1-yl]ethanone
CID 167107047
ethyl (3R)-3-[[4-(1-methylbenzimidazol-2-yl)piperazine-1-carbonyl]amino]-3-phenylpropanoate
CID 92879184

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone?
The IUPAC name of 2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone (CID 155161689) is 2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone.
What is the SMILES notation for 2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone?
The canonical SMILES for 2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone is Cn1c(N2CCN(C(=O)Cc3ccc(C4CC4)cc3)CC2)nc2ccccc21.
What is the InChIKey of 2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone?
The InChIKey is YYYOGBYOYGGHBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O/c1-25-21-5-3-2-4-20(21)24-23(25)27-14-12-26(13-15-27)22(28)16-17-6-8-18(9-7-17)19-10-11-19/h2-9,19H,10-16H2,1H3.
What are the key properties of 2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone?
2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone has a molecular weight of 374.49 g/mol, XLogP of 3.34, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylphenyl)-1-[4-(1-methylbenzimidazol-2-yl)piperazin-1-yl]ethanone is sourced from PubChem (CID 155161689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).