2-(2-phenylethyl)-1-propylbenzimidazole

C18H20N2 — CID 969694

IUPAC2-(2-phenylethyl)-1-propylbenzimidazole
SMILESCCCn1c(CCc2ccccc2)nc2ccccc21
InChIInChI=1S/C18H20N2/c1-2-14-20-17-11-7-6-10-16(17)19-18(20)13-12-15-8-4-3-5-9-15/h3-11H,2,12-14H2,1H3
InChIKeyHDZDJQWNEDYHPC-UHFFFAOYSA-N
MW264.37 g/mol
LogP4.23
Rot. Bonds5

About 2-(2-phenylethyl)-1-propylbenzimidazole

2-(2-phenylethyl)-1-propylbenzimidazole (PubChem CID 969694) has the molecular formula C18H20N2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-(2-phenylethyl)-1-propylbenzimidazole.

Molecular Properties

Compound Name2-(2-phenylethyl)-1-propylbenzimidazole
PubChem CID969694
Molecular FormulaC18H20N2
Molecular Weight264.37 g/mol
Exact Mass264.16
IUPAC Name2-(2-phenylethyl)-1-propylbenzimidazole
SMILESCCCn1c(CCc2ccccc2)nc2ccccc21
InChIInChI=1S/C18H20N2/c1-2-14-20-17-11-7-6-10-16(17)19-18(20)13-12-15-8-4-3-5-9-15/h3-11H,2,12-14H2,1H3
InChIKeyHDZDJQWNEDYHPC-UHFFFAOYSA-N
XLogP4.23
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-propyl-2-[(1-propylbenzimidazol-2-yl)methyl]benzimidazole
CID 102471082
3-[2-(2-phenylethyl)benzimidazol-1-yl]propanoic acid
CID 82144764
1-benzyl-2-propylbenzimidazole
CID 764560
N-methyl-1-phenyl-N-[(1-propylbenzimidazol-2-yl)methyl]methanamine;hydrochloride
CID 171151744
N-[3-[2-(1-propylbenzimidazol-2-yl)ethyl]phenyl]methanesulfonamide
CID 50822859
N,N-dimethyl-3-(1-propylbenzimidazol-2-yl)propan-1-amine
CID 170866848
1-propyl-2-[(1-propylbenzimidazol-2-yl)methoxymethyl]benzimidazole
CID 11302951
2-[2-(2-phenylethyl)benzimidazol-1-yl]acetonitrile
CID 39148173
2,2-dimethyl-3-(1-propylbenzimidazol-2-yl)propanoic acid
CID 79753577
N-methyl-4-(1-propylbenzimidazol-2-yl)butan-1-amine
CID 79750802
1-[(4-chlorophenyl)methyl]-2-(2-phenylethyl)benzimidazole
CID 18878939
1-[(4-tert-butylphenyl)methyl]-2-(2-phenylethyl)benzimidazole
CID 18878938

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylethyl)-1-propylbenzimidazole?
The IUPAC name of 2-(2-phenylethyl)-1-propylbenzimidazole (CID 969694) is 2-(2-phenylethyl)-1-propylbenzimidazole.
What is the SMILES notation for 2-(2-phenylethyl)-1-propylbenzimidazole?
The canonical SMILES for 2-(2-phenylethyl)-1-propylbenzimidazole is CCCn1c(CCc2ccccc2)nc2ccccc21.
What is the InChIKey of 2-(2-phenylethyl)-1-propylbenzimidazole?
The InChIKey is HDZDJQWNEDYHPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2/c1-2-14-20-17-11-7-6-10-16(17)19-18(20)13-12-15-8-4-3-5-9-15/h3-11H,2,12-14H2,1H3.
What are the key properties of 2-(2-phenylethyl)-1-propylbenzimidazole?
2-(2-phenylethyl)-1-propylbenzimidazole has a molecular weight of 264.37 g/mol, XLogP of 4.23, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylethyl)-1-propylbenzimidazole is sourced from PubChem (CID 969694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).