1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one

C24H33N5O2 — CID 75385943

IUPAC1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one
SMILESCC1CCCCN1C(=O)CN1CCN(C(=O)C(C)n2ccnc2-c2ccccc2)CC1
InChIInChI=1S/C24H33N5O2/c1-19-8-6-7-12-28(19)22(30)18-26-14-16-27(17-15-26)24(31)20(2)29-13-11-25-23(29)21-9-4-3-5-10-21/h3-5,9-11,13,19-20H,6-8,12,14-18H2,1-2H3
InChIKeyQILKFQQVJBWQRW-UHFFFAOYSA-N
MW423.56 g/mol
LogP2.66
Rot. Bonds5

About 1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one

1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one (PubChem CID 75385943) has the molecular formula C24H33N5O2 and a molecular weight of 423.56 g/mol. Its IUPAC name is 1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one.

Molecular Properties

Compound Name1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one
PubChem CID75385943
Molecular FormulaC24H33N5O2
Molecular Weight423.56 g/mol
Exact Mass423.26
IUPAC Name1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one
SMILESCC1CCCCN1C(=O)CN1CCN(C(=O)C(C)n2ccnc2-c2ccccc2)CC1
InChIInChI=1S/C24H33N5O2/c1-19-8-6-7-12-28(19)22(30)18-26-14-16-27(17-15-26)24(31)20(2)29-13-11-25-23(29)21-9-4-3-5-10-21/h3-5,9-11,13,19-20H,6-8,12,14-18H2,1-2H3
InChIKeyQILKFQQVJBWQRW-UHFFFAOYSA-N
XLogP2.66
TPSA61.68 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.56
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one 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-(3-hydroxypyridine-2-carbonyl)piperazin-1-yl]-1-[(2R)-2-methylpiperidin-1-yl]ethanone
CID 94824147
1-[(2R)-2-methylpiperidin-1-yl]-2-[4-[(2S)-2-phenylpropyl]piperazin-1-yl]ethanone
CID 95353092
1-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-(2-phenylimidazol-1-yl)propan-1-one
CID 86793748
1-[2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-oxo-1-phenylethyl]piperidin-2-one
CID 56514843
2-[4-(2-indol-1-ylacetyl)piperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone
CID 87040579
2-[4-(2-methylphenyl)piperazin-1-yl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone
CID 92987749
1-(2-methylpiperidin-1-yl)-2-[4-(2-propan-2-ylquinoline-4-carbonyl)piperazin-1-yl]ethanone
CID 55563722
1-[(2S)-2-methylpiperidin-1-yl]-2-[4-[(1R)-1-pyridin-4-ylethyl]piperazin-1-yl]ethanone
CID 95204864
1-[(2R)-2-methylpiperidin-1-yl]-2-[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-1-yl]ethanone
CID 36904859
1-(azepan-1-yl)-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]ethanone
CID 90494396
1-(2-methylpiperidin-1-yl)-2-[4-[(1S,2S)-2-pyridin-3-ylcyclopropanecarbonyl]piperazin-1-yl]ethanone
CID 164633722
1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanone
CID 55563635

Frequently Asked Questions

What is the IUPAC name of 1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one?
The IUPAC name of 1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one (CID 75385943) is 1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one.
What is the SMILES notation for 1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one?
The canonical SMILES for 1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one is CC1CCCCN1C(=O)CN1CCN(C(=O)C(C)n2ccnc2-c2ccccc2)CC1.
What is the InChIKey of 1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one?
The InChIKey is QILKFQQVJBWQRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N5O2/c1-19-8-6-7-12-28(19)22(30)18-26-14-16-27(17-15-26)24(31)20(2)29-13-11-25-23(29)21-9-4-3-5-10-21/h3-5,9-11,13,19-20H,6-8,12,14-18H2,1-2H3.
What are the key properties of 1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one?
1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one has a molecular weight of 423.56 g/mol, XLogP of 2.66, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(2-phenylimidazol-1-yl)propan-1-one is sourced from PubChem (CID 75385943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).