1-cyclopentyl-5,6-dimethylbenzimidazole

C14H18N2 — CID 115900464

IUPAC1-cyclopentyl-5,6-dimethylbenzimidazole
SMILESCc1cc2ncn(C3CCCC3)c2cc1C
InChIInChI=1S/C14H18N2/c1-10-7-13-14(8-11(10)2)16(9-15-13)12-5-3-4-6-12/h7-9,12H,3-6H2,1-2H3
InChIKeyULBLTHWQLRMNJA-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.77
Rot. Bonds1

About 1-cyclopentyl-5,6-dimethylbenzimidazole

1-cyclopentyl-5,6-dimethylbenzimidazole (PubChem CID 115900464) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-cyclopentyl-5,6-dimethylbenzimidazole.

Molecular Properties

Compound Name1-cyclopentyl-5,6-dimethylbenzimidazole
PubChem CID115900464
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name1-cyclopentyl-5,6-dimethylbenzimidazole
SMILESCc1cc2ncn(C3CCCC3)c2cc1C
InChIInChI=1S/C14H18N2/c1-10-7-13-14(8-11(10)2)16(9-15-13)12-5-3-4-6-12/h7-9,12H,3-6H2,1-2H3
InChIKeyULBLTHWQLRMNJA-UHFFFAOYSA-N
XLogP3.77
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-5,6-dimethylbenzimidazole?
The IUPAC name of 1-cyclopentyl-5,6-dimethylbenzimidazole (CID 115900464) is 1-cyclopentyl-5,6-dimethylbenzimidazole.
What is the SMILES notation for 1-cyclopentyl-5,6-dimethylbenzimidazole?
The canonical SMILES for 1-cyclopentyl-5,6-dimethylbenzimidazole is Cc1cc2ncn(C3CCCC3)c2cc1C.
What is the InChIKey of 1-cyclopentyl-5,6-dimethylbenzimidazole?
The InChIKey is ULBLTHWQLRMNJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-10-7-13-14(8-11(10)2)16(9-15-13)12-5-3-4-6-12/h7-9,12H,3-6H2,1-2H3.
What are the key properties of 1-cyclopentyl-5,6-dimethylbenzimidazole?
1-cyclopentyl-5,6-dimethylbenzimidazole has a molecular weight of 214.31 g/mol, XLogP of 3.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-5,6-dimethylbenzimidazole is sourced from PubChem (CID 115900464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).