1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone

C18H24N2O — CID 115781900

IUPAC1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone
SMILESCCCn1c(CC(=O)C2(C)CCCC2)nc2ccccc21
InChIInChI=1S/C18H24N2O/c1-3-12-20-15-9-5-4-8-14(15)19-17(20)13-16(21)18(2)10-6-7-11-18/h4-5,8-9H,3,6-7,10-13H2,1-2H3
InChIKeyFPCLAEHPPKVAOW-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.14
Rot. Bonds5

About 1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone

1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone (PubChem CID 115781900) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone.

Molecular Properties

Compound Name1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone
PubChem CID115781900
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone
SMILESCCCn1c(CC(=O)C2(C)CCCC2)nc2ccccc21
InChIInChI=1S/C18H24N2O/c1-3-12-20-15-9-5-4-8-14(15)19-17(20)13-16(21)18(2)10-6-7-11-18/h4-5,8-9H,3,6-7,10-13H2,1-2H3
InChIKeyFPCLAEHPPKVAOW-UHFFFAOYSA-N
XLogP4.14
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methylpyrrolidin-3-yl)-2-(1-propylbenzimidazol-2-yl)ethanone
CID 116570155
2-(1-ethylbenzimidazol-2-yl)-1-(1-methylcyclopentyl)ethanone
CID 115782680
2-(1-methylbenzimidazol-2-yl)-1-(4-methylpiperidin-4-yl)ethanone
CID 116567574
1-[(1-propylbenzimidazol-2-yl)methyl]cyclobutan-1-ol
CID 79753348
4-amino-1-(1-propylbenzimidazol-2-yl)butan-2-one
CID 116550850
4,4-dimethyl-1-(1-propylbenzimidazol-2-yl)pentan-2-one
CID 79754432
3-hydroxy-1-(1-propylbenzimidazol-2-yl)pentan-2-one
CID 103453160
3-methyl-1-(1-propylbenzimidazol-2-yl)hexan-2-one
CID 115781923
1-(1-aminocyclopentyl)-3-(1-ethylbenzimidazol-2-yl)propan-2-one
CID 116578839
1-propyl-2-[(1-propylbenzimidazol-2-yl)methyl]benzimidazole
CID 102471082
1-(1,4-dioxan-2-yl)-2-(1-propylbenzimidazol-2-yl)ethanone
CID 115824359
2-(1-propylbenzimidazol-2-yl)-1-pyrimidin-5-ylethanone
CID 102923180

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone?
The IUPAC name of 1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone (CID 115781900) is 1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone.
What is the SMILES notation for 1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone?
The canonical SMILES for 1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone is CCCn1c(CC(=O)C2(C)CCCC2)nc2ccccc21.
What is the InChIKey of 1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone?
The InChIKey is FPCLAEHPPKVAOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-3-12-20-15-9-5-4-8-14(15)19-17(20)13-16(21)18(2)10-6-7-11-18/h4-5,8-9H,3,6-7,10-13H2,1-2H3.
What are the key properties of 1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone?
1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone has a molecular weight of 284.40 g/mol, XLogP of 4.14, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanone is sourced from PubChem (CID 115781900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).