(3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone

C20H25Cl2N3O2 — CID 10179744

IUPAC(3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone
SMILESCC(C)N1CCC(COc2ncc(C(=O)c3cc(Cl)cc(Cl)c3)n2C)CC1
InChIInChI=1S/C20H25Cl2N3O2/c1-13(2)25-6-4-14(5-7-25)12-27-20-23-11-18(24(20)3)19(26)15-8-16(21)10-17(22)9-15/h8-11,13-14H,4-7,12H2,1-3H3
InChIKeyHFOLGAYRFUFNIA-UHFFFAOYSA-N
MW410.35 g/mol
LogP4.46
Rot. Bonds6

About (3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone

(3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone (PubChem CID 10179744) has the molecular formula C20H25Cl2N3O2 and a molecular weight of 410.35 g/mol. Its IUPAC name is (3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone.

Molecular Properties

Compound Name(3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone
PubChem CID10179744
Molecular FormulaC20H25Cl2N3O2
Molecular Weight410.35 g/mol
Exact Mass409.13
IUPAC Name(3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone
SMILESCC(C)N1CCC(COc2ncc(C(=O)c3cc(Cl)cc(Cl)c3)n2C)CC1
InChIInChI=1S/C20H25Cl2N3O2/c1-13(2)25-6-4-14(5-7-25)12-27-20-23-11-18(24(20)3)19(26)15-8-16(21)10-17(22)9-15/h8-11,13-14H,4-7,12H2,1-3H3
InChIKeyHFOLGAYRFUFNIA-UHFFFAOYSA-N
XLogP4.46
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.35
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-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

Frequently Asked Questions

What is the IUPAC name of (3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone?
The IUPAC name of (3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone (CID 10179744) is (3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone.
What is the SMILES notation for (3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone?
The canonical SMILES for (3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone is CC(C)N1CCC(COc2ncc(C(=O)c3cc(Cl)cc(Cl)c3)n2C)CC1.
What is the InChIKey of (3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone?
The InChIKey is HFOLGAYRFUFNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25Cl2N3O2/c1-13(2)25-6-4-14(5-7-25)12-27-20-23-11-18(24(20)3)19(26)15-8-16(21)10-17(22)9-15/h8-11,13-14H,4-7,12H2,1-3H3.
What are the key properties of (3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone?
(3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone has a molecular weight of 410.35 g/mol, XLogP of 4.46, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichlorophenyl)-[3-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methoxy]imidazol-4-yl]methanone is sourced from PubChem (CID 10179744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).