1-(benzimidazol-1-yl)hexan-2-amine

C13H19N3 — CID 105125140

IUPAC1-(benzimidazol-1-yl)hexan-2-amine
SMILESCCCCC(N)Cn1cnc2ccccc21
InChIInChI=1S/C13H19N3/c1-2-3-6-11(14)9-16-10-15-12-7-4-5-8-13(12)16/h4-5,7-8,10-11H,2-3,6,9,14H2,1H3
InChIKeyMIFZTQYCNPYUCK-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.55
Rot. Bonds5

About 1-(benzimidazol-1-yl)hexan-2-amine

1-(benzimidazol-1-yl)hexan-2-amine (PubChem CID 105125140) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 1-(benzimidazol-1-yl)hexan-2-amine.

Molecular Properties

Compound Name1-(benzimidazol-1-yl)hexan-2-amine
PubChem CID105125140
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name1-(benzimidazol-1-yl)hexan-2-amine
SMILESCCCCC(N)Cn1cnc2ccccc21
InChIInChI=1S/C13H19N3/c1-2-3-6-11(14)9-16-10-15-12-7-4-5-8-13(12)16/h4-5,7-8,10-11H,2-3,6,9,14H2,1H3
InChIKeyMIFZTQYCNPYUCK-UHFFFAOYSA-N
XLogP2.55
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-heptadecylicosyl)benzimidazole
CID 59202249
1-(benzimidazol-1-yl)non-8-en-2-amine
CID 107011933
1-(benzimidazol-1-yl)decan-2-ol
CID 105085738
1-(benzimidazol-1-yl)hept-5-yn-2-amine
CID 105181339
1-(benzimidazol-1-yl)-4-ethylhexan-2-amine
CID 105176644
[1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine
CID 105288251
1-(benzimidazol-1-yl)pent-4-en-2-amine
CID 105107781
bis(1-butylbenzimidazole);ethane
CID 142164287
1-(benzimidazol-1-yl)-4-(1-methylpyrazol-4-yl)butan-2-amine
CID 103029759
1-(benzimidazol-1-yl)-3-(5-ethyl-2-pyridinyl)propan-2-amine
CID 105168831
1-(benzimidazol-1-yl)butan-2-ol
CID 53276318
1-(benzimidazol-1-yl)propan-2-ol
CID 22504258

Frequently Asked Questions

What is the IUPAC name of 1-(benzimidazol-1-yl)hexan-2-amine?
The IUPAC name of 1-(benzimidazol-1-yl)hexan-2-amine (CID 105125140) is 1-(benzimidazol-1-yl)hexan-2-amine.
What is the SMILES notation for 1-(benzimidazol-1-yl)hexan-2-amine?
The canonical SMILES for 1-(benzimidazol-1-yl)hexan-2-amine is CCCCC(N)Cn1cnc2ccccc21.
What is the InChIKey of 1-(benzimidazol-1-yl)hexan-2-amine?
The InChIKey is MIFZTQYCNPYUCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-2-3-6-11(14)9-16-10-15-12-7-4-5-8-13(12)16/h4-5,7-8,10-11H,2-3,6,9,14H2,1H3.
What are the key properties of 1-(benzimidazol-1-yl)hexan-2-amine?
1-(benzimidazol-1-yl)hexan-2-amine has a molecular weight of 217.32 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzimidazol-1-yl)hexan-2-amine is sourced from PubChem (CID 105125140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).