1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole

C10H16N2 — CID 126996535

IUPAC1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole
SMILESCC1Cc2ncn(C)c2CC1C
InChIInChI=1S/C10H16N2/c1-7-4-9-10(5-8(7)2)12(3)6-11-9/h6-8H,4-5H2,1-3H3
InChIKeyMFNUGCULTNXYQF-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.79
Rot. Bonds

About 1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole

1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole (PubChem CID 126996535) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole.

Molecular Properties

Compound Name1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole
PubChem CID126996535
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole
SMILESCC1Cc2ncn(C)c2CC1C
InChIInChI=1S/C10H16N2/c1-7-4-9-10(5-8(7)2)12(3)6-11-9/h6-8H,4-5H2,1-3H3
InChIKeyMFNUGCULTNXYQF-UHFFFAOYSA-N
XLogP1.79
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3-methyl-5,6-dihydro-4H-cyclopenta[d]imidazol-5-yl)methanol
CID 20738529
3-methyl-4,7-dihydroimidazo[4,5-c]pyridine
CID 160646561
2-(3-methyl-4,5,6,7-tetrahydrobenzimidazol-5-yl)ethanamine
CID 83434456
1-methyl-4,5,6,7-tetrahydrobenzimidazole-5-carbonyl chloride
CID 10821839
(6R)-3-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-6-carboxylic acid;hydrochloride
CID 162341617
3-methyl-5,6,7,8-tetrahydro-4H-imidazo[4,5-d]azepine
CID 58398166
5,6-dimethyl-2-(1-methylimidazol-4-yl)-4,5,6,7-tetrahydro-1H-benzimidazole
CID 114023099
[1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol
CID 131695725
2-(5,6-dimethyl-4,5,6,7-tetrahydrobenzimidazol-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 128567560
N-[(1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-6-yl)methyl]pyrimidin-2-amine
CID 131696076
3,7-dimethyl-5-propan-2-yl-6,7-dihydroimidazo[4,5-b]pyridine
CID 155109534
6-(ethoxymethyl)-5-ethylsulfonyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 131696107

Frequently Asked Questions

What is the IUPAC name of 1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole?
The IUPAC name of 1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole (CID 126996535) is 1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole.
What is the SMILES notation for 1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole?
The canonical SMILES for 1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole is CC1Cc2ncn(C)c2CC1C.
What is the InChIKey of 1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole?
The InChIKey is MFNUGCULTNXYQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-7-4-9-10(5-8(7)2)12(3)6-11-9/h6-8H,4-5H2,1-3H3.
What are the key properties of 1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole?
1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole has a molecular weight of 164.25 g/mol, XLogP of 1.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,6-trimethyl-4,5,6,7-tetrahydrobenzimidazole is sourced from PubChem (CID 126996535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).