4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole

C15H24N2 — CID 82947054

IUPAC4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole
SMILESCC1Cc2[nH]c(C3(C)CCCC3)nc2C(C)C1
InChIInChI=1S/C15H24N2/c1-10-8-11(2)13-12(9-10)16-14(17-13)15(3)6-4-5-7-15/h10-11H,4-9H2,1-3H3,(H,16,17)
InChIKeyHDAJONCAKMQTCN-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.93
Rot. Bonds1

About 4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole

4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole (PubChem CID 82947054) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole.

Molecular Properties

Compound Name4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole
PubChem CID82947054
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole
SMILESCC1Cc2[nH]c(C3(C)CCCC3)nc2C(C)C1
InChIInChI=1S/C15H24N2/c1-10-8-11(2)13-12(9-10)16-14(17-13)15(3)6-4-5-7-15/h10-11H,4-9H2,1-3H3,(H,16,17)
InChIKeyHDAJONCAKMQTCN-UHFFFAOYSA-N
XLogP3.93
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole?
The IUPAC name of 4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole (CID 82947054) is 4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole.
What is the SMILES notation for 4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole?
The canonical SMILES for 4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole is CC1Cc2[nH]c(C3(C)CCCC3)nc2C(C)C1.
What is the InChIKey of 4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole?
The InChIKey is HDAJONCAKMQTCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-10-8-11(2)13-12(9-10)16-14(17-13)15(3)6-4-5-7-15/h10-11H,4-9H2,1-3H3,(H,16,17).
What are the key properties of 4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole?
4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole has a molecular weight of 232.37 g/mol, XLogP of 3.93, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-(1-methylcyclopentyl)-4,5,6,7-tetrahydro-1H-benzimidazole is sourced from PubChem (CID 82947054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).