1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride

C15H24Cl2N4O — CID 44888954

IUPAC1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride
SMILESCCn1c(NCCN2CCOCC2)nc2ccccc21.Cl.Cl
InChIInChI=1S/C15H22N4O.2ClH/c1-2-19-14-6-4-3-5-13(14)17-15(19)16-7-8-18-9-11-20-12-10-18;;/h3-6H,2,7-12H2,1H3,(H,16,17);2*1H
InChIKeyLTZZPNQRKHPSSG-UHFFFAOYSA-N
MW347.29 g/mol
LogP2.64
Rot. Bonds5

About 1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride

1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride (PubChem CID 44888954) has the molecular formula C15H24Cl2N4O and a molecular weight of 347.29 g/mol. Its IUPAC name is 1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride.

Molecular Properties

Compound Name1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride
PubChem CID44888954
Molecular FormulaC15H24Cl2N4O
Molecular Weight347.29 g/mol
Exact Mass346.13
IUPAC Name1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride
SMILESCCn1c(NCCN2CCOCC2)nc2ccccc21.Cl.Cl
InChIInChI=1S/C15H22N4O.2ClH/c1-2-19-14-6-4-3-5-13(14)17-15(19)16-7-8-18-9-11-20-12-10-18;;/h3-6H,2,7-12H2,1H3,(H,16,17);2*1H
InChIKeyLTZZPNQRKHPSSG-UHFFFAOYSA-N
XLogP2.64
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.29
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzimidazol-2-amine;hydrobromide
CID 18460636
1,6-diethyl-N-(3-morpholin-4-ylpropyl)benzimidazol-2-amine
CID 143063274
N-(2-piperazin-1-ylethyl)-1-propylbenzimidazol-2-amine
CID 978261
1-(2-morpholin-4-ylethyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzimidazol-2-amine;hydrochloride
CID 171700310
1-(3-methylbutyl)-N-(2-piperazin-1-ylethyl)benzimidazol-2-amine
CID 924766
N-(2-morpholin-4-ylethyl)-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
CID 5309921
2-(2-methylbenzimidazol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 848727
2-[[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]amino]ethanol chloride
CID 53313615
4-[(2-methylbenzimidazol-1-yl)methyl]morpholine
CID 3600029
N-[1-(2-morpholin-4-ylethyl)benzimidazol-2-yl]-2-phenoxypropanamide
CID 56725089
N-methyl-1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine
CID 82359477
N-(2-chloroethyl)-1-propylbenzimidazol-2-amine
CID 3066877

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride?
The IUPAC name of 1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride (CID 44888954) is 1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride.
What is the SMILES notation for 1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride?
The canonical SMILES for 1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride is CCn1c(NCCN2CCOCC2)nc2ccccc21.Cl.Cl.
What is the InChIKey of 1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride?
The InChIKey is LTZZPNQRKHPSSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O.2ClH/c1-2-19-14-6-4-3-5-13(14)17-15(19)16-7-8-18-9-11-20-12-10-18;;/h3-6H,2,7-12H2,1H3,(H,16,17);2*1H.
What are the key properties of 1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride?
1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride has a molecular weight of 347.29 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride is sourced from PubChem (CID 44888954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).