[4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone

C23H32N4O2 — CID 25124682

IUPAC[4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone
SMILESCC(C)N1CCN(C(=O)C2CCC(Oc3ccc(-n4ccnc4)cc3)CC2)CC1
InChIInChI=1S/C23H32N4O2/c1-18(2)25-13-15-26(16-14-25)23(28)19-3-7-21(8-4-19)29-22-9-5-20(6-10-22)27-12-11-24-17-27/h5-6,9-12,17-19,21H,3-4,7-8,13-16H2,1-2H3
InChIKeyYCHZSVIHJARVRP-UHFFFAOYSA-N
MW396.54 g/mol
LogP3.36
Rot. Bonds5

About [4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone

[4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone (PubChem CID 25124682) has the molecular formula C23H32N4O2 and a molecular weight of 396.54 g/mol. Its IUPAC name is [4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name[4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone
PubChem CID25124682
Molecular FormulaC23H32N4O2
Molecular Weight396.54 g/mol
Exact Mass396.25
IUPAC Name[4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone
SMILESCC(C)N1CCN(C(=O)C2CCC(Oc3ccc(-n4ccnc4)cc3)CC2)CC1
InChIInChI=1S/C23H32N4O2/c1-18(2)25-13-15-26(16-14-25)23(28)19-3-7-21(8-4-19)29-22-9-5-20(6-10-22)27-12-11-24-17-27/h5-6,9-12,17-19,21H,3-4,7-8,13-16H2,1-2H3
InChIKeyYCHZSVIHJARVRP-UHFFFAOYSA-N
XLogP3.36
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.54
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-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

cyclopropyl-[4-(4-methoxyphenoxy)piperidin-1-yl]methanone
CID 110396800
morpholin-4-yl-[4-[4-(1-propan-2-ylpiperidin-4-yl)oxyphenyl]piperazin-1-yl]methanone
CID 59250205
(4-imidazol-1-ylphenyl) acetate
CID 594823
1-[4-(4-imidazol-1-ylanilino)piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 154750878
4-(4-piperidin-1-ylphenoxy)-1-propan-2-ylpiperidine
CID 141090677
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-(1-thiophen-2-ylethyl)benzamide
CID 45216516
[4-(4-benzoylanilino)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 24900546
[4-(1,3-dihydroisoindol-2-yl)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 24901057
(4-propan-2-ylpiperazin-1-yl)-[6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-2-yl]methanone
CID 69070920
1-(4-butan-2-yloxyphenyl)imidazole
CID 91295981
N-[1-(4-imidazol-1-ylphenyl)ethyl]-1-methylpiperidin-4-amine
CID 43215873
1-[[4-(4-propan-2-ylpiperazine-1-carbonyl)cyclohexyl]methyl]pyrrole-2,5-dione
CID 168839101

Frequently Asked Questions

What is the IUPAC name of [4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone?
The IUPAC name of [4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone (CID 25124682) is [4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone.
What is the SMILES notation for [4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone?
The canonical SMILES for [4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone is CC(C)N1CCN(C(=O)C2CCC(Oc3ccc(-n4ccnc4)cc3)CC2)CC1.
What is the InChIKey of [4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone?
The InChIKey is YCHZSVIHJARVRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N4O2/c1-18(2)25-13-15-26(16-14-25)23(28)19-3-7-21(8-4-19)29-22-9-5-20(6-10-22)27-12-11-24-17-27/h5-6,9-12,17-19,21H,3-4,7-8,13-16H2,1-2H3.
What are the key properties of [4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone?
[4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone has a molecular weight of 396.54 g/mol, XLogP of 3.36, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-imidazol-1-ylphenoxy)cyclohexyl]-(4-propan-2-ylpiperazin-1-yl)methanone is sourced from PubChem (CID 25124682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).