2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine

C15H22N4O — CID 82310629

IUPAC2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine
SMILESCc1ccc2c(c1)nc(CN1CCOCC1)n2CCN
InChIInChI=1S/C15H22N4O/c1-12-2-3-14-13(10-12)17-15(19(14)5-4-16)11-18-6-8-20-9-7-18/h2-3,10H,4-9,11,16H2,1H3
InChIKeyXTSGFLXHCSPJKR-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.14
Rot. Bonds4

About 2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine

2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine (PubChem CID 82310629) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine.

Molecular Properties

Compound Name2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine
PubChem CID82310629
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine
SMILESCc1ccc2c(c1)nc(CN1CCOCC1)n2CCN
InChIInChI=1S/C15H22N4O/c1-12-2-3-14-13(10-12)17-15(19(14)5-4-16)11-18-6-8-20-9-7-18/h2-3,10H,4-9,11,16H2,1H3
InChIKeyXTSGFLXHCSPJKR-UHFFFAOYSA-N
XLogP1.14
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(1,4-diazepan-1-ylmethyl)-5-methylbenzimidazol-1-yl]ethanamine
CID 82310634
5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine
CID 43661563
5-methyl-2-(piperazin-1-ylmethyl)-1-propylbenzimidazole
CID 62316185
2-[5-fluoro-2-(pyrrolidin-1-ylmethyl)benzimidazol-1-yl]ethanamine
CID 82310602
3-[5-methyl-2-(piperidin-1-ylmethyl)benzimidazol-1-yl]propan-1-ol
CID 82311837
2-[5,6-dimethyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanol
CID 82311786
4-[(5-chloro-1-methylbenzimidazol-2-yl)methyl]morpholine
CID 851996
4-[[1-[4-(2,4-dimethylphenoxy)butyl]benzimidazol-2-yl]methyl]morpholine
CID 18885145
1-(2-aminoethyl)-5-methylbenzimidazol-2-amine
CID 84771588
4-[2-(chloromethyl)-5-methylbenzimidazol-1-yl]morpholine
CID 83017150
2-(chloromethyl)-5-methyl-1-(2-pyrrolidin-1-ylethyl)benzimidazole
CID 62640925
2-[2-(aminomethyl)-5-methylbenzimidazol-1-yl]ethanol
CID 82332966

Frequently Asked Questions

What is the IUPAC name of 2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine?
The IUPAC name of 2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine (CID 82310629) is 2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine.
What is the SMILES notation for 2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine?
The canonical SMILES for 2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine is Cc1ccc2c(c1)nc(CN1CCOCC1)n2CCN.
What is the InChIKey of 2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine?
The InChIKey is XTSGFLXHCSPJKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-12-2-3-14-13(10-12)17-15(19(14)5-4-16)11-18-6-8-20-9-7-18/h2-3,10H,4-9,11,16H2,1H3.
What are the key properties of 2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine?
2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine has a molecular weight of 274.37 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine is sourced from PubChem (CID 82310629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).