4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole

C15H22N2 — CID 173284088

IUPAC4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole
SMILESCC(C)c1cccc(C(C)C)c1C1=NCNC1
InChIInChI=1S/C15H22N2/c1-10(2)12-6-5-7-13(11(3)4)15(12)14-8-16-9-17-14/h5-7,10-11,16H,8-9H2,1-4H3
InChIKeyKRBGJIAGVCESDX-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.28
Rot. Bonds3

About 4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole

4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole (PubChem CID 173284088) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole
PubChem CID173284088
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole
SMILESCC(C)c1cccc(C(C)C)c1C1=NCNC1
InChIInChI=1S/C15H22N2/c1-10(2)12-6-5-7-13(11(3)4)15(12)14-8-16-9-17-14/h5-7,10-11,16H,8-9H2,1-4H3
InChIKeyKRBGJIAGVCESDX-UHFFFAOYSA-N
XLogP3.28
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,6-Diisopropyl-benzyl)-4,5-dihydro-1H-imidazole
CID 58951908
2-[(2-methyl-3-propan-2-ylphenyl)methyl]-4,5-dihydro-1H-imidazole
CID 122184446
4-Phenyl-3-imidazoline
CID 56621221
4-[(3,4-Dihydronaphthalen-2-yl)methyl]-2,5-dihydro-1H-imidazole
CID 124655
4-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1H-imidazole
CID 57077686
4-(2-fluorophenyl)-2,5-dihydro-1H-imidazole
CID 57274818
6-[3-[(2,6-dimethylphenyl)methyl]but-3-enyl]-2-[2-(2-fluoro-6-methylcyclohexa-2,4-dien-1-yl)ethyl]-4-[(2R,3Z)-hexa-3,5-dien-2-yl]-1,2-dihydropyrimidine
CID 132050913
4-(2-fluoro-3-methylphenyl)-5-methyl-3,5-dihydro-2H-benzo[e]benzimidazole
CID 166804198
(2R)-4-(4-fluorophenyl)-2-methyl-2,5-dihydro-1H-imidazole
CID 166943107
2-[4-[2-(2-ethyliminobut-3-enyl)-4-(6-fluoro-5,6-dimethylnonan-4-yl)phenyl]phenyl]-N-methylethanamine
CID 169646899
1-[[(E)-4-fluoro-4-methyl-1-(2-methyl-5-propan-2-ylphenyl)pent-2-enylidene]amino]-N-methylmethanamine
CID 173701197
2,5,5-Trimethyl-4-phenyl-3-imidazoline
CID 12730701

Frequently Asked Questions

What is the IUPAC name of 4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole?
The IUPAC name of 4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole (CID 173284088) is 4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole.
What is the SMILES notation for 4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole?
The canonical SMILES for 4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole is CC(C)c1cccc(C(C)C)c1C1=NCNC1.
What is the InChIKey of 4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole?
The InChIKey is KRBGJIAGVCESDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-10(2)12-6-5-7-13(11(3)4)15(12)14-8-16-9-17-14/h5-7,10-11,16H,8-9H2,1-4H3.
What are the key properties of 4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole?
4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole has a molecular weight of 230.35 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2,6-di(propan-2-yl)phenyl]-2,5-dihydro-1H-imidazole is sourced from PubChem (CID 173284088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).