4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole

C12H18N2 — CID 141109299

IUPAC4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole
SMILESCc1ccc2c(c1C)N(C(C)C)CN2
InChIInChI=1S/C12H18N2/c1-8(2)14-7-13-11-6-5-9(3)10(4)12(11)14/h5-6,8,13H,7H2,1-4H3
InChIKeyHWBCGFYKKKRMOB-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.90
Rot. Bonds1

About 4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole

4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole (PubChem CID 141109299) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole.

Molecular Properties

Compound Name4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole
PubChem CID141109299
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole
SMILESCc1ccc2c(c1C)N(C(C)C)CN2
InChIInChI=1S/C12H18N2/c1-8(2)14-7-13-11-6-5-9(3)10(4)12(11)14/h5-6,8,13H,7H2,1-4H3
InChIKeyHWBCGFYKKKRMOB-UHFFFAOYSA-N
XLogP2.90
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole 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

3,5-dimethyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline
CID 115095460
2,6,11,15-tetra(propan-2-yl)-2,6,11,15-tetrazatricyclo[14.2.2.27,10]docosa-1(19),7,9,16(20),17,21-hexaene
CID 102478540
3,6-di(propan-2-yl)-1,2-dihydropyrimidin-4-one
CID 140891182
3-(2,3-dihydrobenzimidazol-1-yl)-N-methylbutan-1-amine
CID 143325148
2-propan-2-yl-3-(2,3,6-trimethylphenyl)-1,2-dihydroimidazole
CID 142521713
1,3,3,7,8-pentamethyl-4H-quinoxalin-2-one
CID 84623091
ruthenium;1,2,3,4-tetramethylbenzene
CID 158325243
5-(difluoromethyl)-N-[(3,5-dimethyl-1,2-dihydrobenzimidazol-4-yl)methyl]thiophen-2-amine
CID 146642811
5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
CID 115097965
6-methyl-3-propan-2-yl-4-propan-2-ylidene-2,5-dihydro-1H-pyrimidin-5-ide;yttrium
CID 58763049
3-methyl-5-propan-2-yl-1,2-dihydrobenzimidazole
CID 162748632
5-(2-aminoethyl)-6,7-dimethyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one
CID 84627563

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole?
The IUPAC name of 4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole (CID 141109299) is 4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole.
What is the SMILES notation for 4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole?
The canonical SMILES for 4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole is Cc1ccc2c(c1C)N(C(C)C)CN2.
What is the InChIKey of 4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole?
The InChIKey is HWBCGFYKKKRMOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-8(2)14-7-13-11-6-5-9(3)10(4)12(11)14/h5-6,8,13H,7H2,1-4H3.
What are the key properties of 4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole?
4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole has a molecular weight of 190.29 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-3-propan-2-yl-1,2-dihydrobenzimidazole is sourced from PubChem (CID 141109299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).