(4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone

C15H16ClN3O — CID 47089047

IUPAC(4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone
SMILESO=C(c1ccc(Cl)cc1)N1CCC(n2ccnc2)CC1
InChIInChI=1S/C15H16ClN3O/c16-13-3-1-12(2-4-13)15(20)18-8-5-14(6-9-18)19-10-7-17-11-19/h1-4,7,10-11,14H,5-6,8-9H2
InChIKeyHZCPZDWSPWTCOC-UHFFFAOYSA-N
MW289.77 g/mol
LogP3.01
Rot. Bonds2

About (4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone

(4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone (PubChem CID 47089047) has the molecular formula C15H16ClN3O and a molecular weight of 289.77 g/mol. Its IUPAC name is (4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone
PubChem CID47089047
Molecular FormulaC15H16ClN3O
Molecular Weight289.77 g/mol
Exact Mass289.10
IUPAC Name(4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone
SMILESO=C(c1ccc(Cl)cc1)N1CCC(n2ccnc2)CC1
InChIInChI=1S/C15H16ClN3O/c16-13-3-1-12(2-4-13)15(20)18-8-5-14(6-9-18)19-10-7-17-11-19/h1-4,7,10-11,14H,5-6,8-9H2
InChIKeyHZCPZDWSPWTCOC-UHFFFAOYSA-N
XLogP3.01
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (4-chlorophenyl)-(4-imidazol-1-ylpiperidin-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

[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-(4-chlorophenyl)methanone
CID 107108689
(4-imidazol-1-ylpiperidin-1-yl)-thiophen-2-ylmethanone
CID 136579926
(6-chloroquinolin-8-yl)-(4-imidazol-1-ylpiperidin-1-yl)methanone
CID 51107660
[1-(4-chlorobenzoyl)piperidin-4-yl]azanium
CID 7183143
3-cyclopentyl-6-(4-imidazol-1-ylpiperidine-1-carbonyl)-1H-benzimidazol-2-one
CID 138993159
[4-(imidazol-1-ylmethyl)phenyl]-[4-(triazol-2-yl)piperidin-1-yl]methanone
CID 121165004
(4-imidazol-1-ylpiperidin-1-yl)-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-yl)methanone
CID 138993158
(4-chlorophenyl)-[4-(3-ethyl-1,2,4-triazol-4-yl)piperidin-1-yl]methanone
CID 91914710
(4-chlorophenyl)-[4-(methylamino)piperidin-1-yl]methanone
CID 83728657
(4-chlorophenyl)-[4-(4-chlorophenyl)sulfonylpiperidin-1-yl]methanone
CID 67168197
1-(4-chlorobenzoyl)-N,N-diethylpiperidine-4-carboxamide
CID 17119192
(4-imidazol-1-ylpiperidin-1-yl)-[(5S)-5-phenyl-4,5-dihydro-1,2-oxazol-3-yl]methanone
CID 94823527

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone?
The IUPAC name of (4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone (CID 47089047) is (4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone.
What is the SMILES notation for (4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone?
The canonical SMILES for (4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone is O=C(c1ccc(Cl)cc1)N1CCC(n2ccnc2)CC1.
What is the InChIKey of (4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone?
The InChIKey is HZCPZDWSPWTCOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O/c16-13-3-1-12(2-4-13)15(20)18-8-5-14(6-9-18)19-10-7-17-11-19/h1-4,7,10-11,14H,5-6,8-9H2.
What are the key properties of (4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone?
(4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone has a molecular weight of 289.77 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-(4-imidazol-1-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 47089047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).