1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole

C15H16Cl2N2 — CID 165428017

IUPAC1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole
SMILESClc1cccc(Cl)c1-c1nccn1CC1CCCC1
InChIInChI=1S/C15H16Cl2N2/c16-12-6-3-7-13(17)14(12)15-18-8-9-19(15)10-11-4-1-2-5-11/h3,6-9,11H,1-2,4-5,10H2
InChIKeyAUUBXGCPNUJUMR-UHFFFAOYSA-N
MW295.21 g/mol
LogP5.05
Rot. Bonds3

About 1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole

1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole (PubChem CID 165428017) has the molecular formula C15H16Cl2N2 and a molecular weight of 295.21 g/mol. Its IUPAC name is 1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole.

Molecular Properties

Compound Name1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole
PubChem CID165428017
Molecular FormulaC15H16Cl2N2
Molecular Weight295.21 g/mol
Exact Mass294.07
IUPAC Name1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole
SMILESClc1cccc(Cl)c1-c1nccn1CC1CCCC1
InChIInChI=1S/C15H16Cl2N2/c16-12-6-3-7-13(17)14(12)15-18-8-9-19(15)10-11-4-1-2-5-11/h3,6-9,11H,1-2,4-5,10H2
InChIKeyAUUBXGCPNUJUMR-UHFFFAOYSA-N
XLogP5.05
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.21
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1R,3S)-3-[[2-(2,3-dichlorophenyl)imidazol-1-yl]methyl]cyclohexan-1-amine
CID 154568600
1-(cyclobutylmethyl)-2-thiophen-2-ylimidazole
CID 115917906
4-[1-(cyclobutylmethyl)imidazol-2-yl]aniline
CID 65458282
1-(cyclopentylmethyl)-2-(3,4-dimethoxyphenyl)imidazole
CID 165421175
2-[2-(2-chloro-6-fluorophenyl)imidazol-1-yl]ethanol
CID 82560649
4-[[2-(5-chlorothiophen-2-yl)imidazol-1-yl]methyl]piperidine;dihydrochloride
CID 171340117
3-[[2-(2-chloro-6-fluorophenyl)imidazol-1-yl]methyl]-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole
CID 56873192
4-[1-[[(3R)-oxan-3-yl]methyl]imidazol-2-yl]-2,1,3-benzoxadiazole
CID 95554101
1-(cyclopentylmethyl)imidazole-2-carboxylic acid
CID 84665405
N-cyclohexyl-1-(cyclohexylmethyl)imidazol-2-amine
CID 106561648
4-[2-(2,6-dichlorophenyl)imidazol-1-yl]cyclohexane-1-carboxylic acid
CID 166619085
4-[1-(oxan-4-ylmethyl)imidazol-2-yl]pyridine
CID 155912859

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole?
The IUPAC name of 1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole (CID 165428017) is 1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole.
What is the SMILES notation for 1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole?
The canonical SMILES for 1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole is Clc1cccc(Cl)c1-c1nccn1CC1CCCC1.
What is the InChIKey of 1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole?
The InChIKey is AUUBXGCPNUJUMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2/c16-12-6-3-7-13(17)14(12)15-18-8-9-19(15)10-11-4-1-2-5-11/h3,6-9,11H,1-2,4-5,10H2.
What are the key properties of 1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole?
1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole has a molecular weight of 295.21 g/mol, XLogP of 5.05, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylmethyl)-2-(2,6-dichlorophenyl)imidazole is sourced from PubChem (CID 165428017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).