2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine

C14H17N5S — CID 105164975

IUPAC2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine
SMILESCCn1c(CC(NC)c2cnns2)nc2ccccc21
InChIInChI=1S/C14H17N5S/c1-3-19-12-7-5-4-6-10(12)17-14(19)8-11(15-2)13-9-16-18-20-13/h4-7,9,11,15H,3,8H2,1-2H3
InChIKeyQWSMEBZVVQZZMT-UHFFFAOYSA-N
MW287.39 g/mol
LogP2.41
Rot. Bonds5

About 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine

2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine (PubChem CID 105164975) has the molecular formula C14H17N5S and a molecular weight of 287.39 g/mol. Its IUPAC name is 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine
PubChem CID105164975
Molecular FormulaC14H17N5S
Molecular Weight287.39 g/mol
Exact Mass287.12
IUPAC Name2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine
SMILESCCn1c(CC(NC)c2cnns2)nc2ccccc21
InChIInChI=1S/C14H17N5S/c1-3-19-12-7-5-4-6-10(12)17-14(19)8-11(15-2)13-9-16-18-20-13/h4-7,9,11,15H,3,8H2,1-2H3
InChIKeyQWSMEBZVVQZZMT-UHFFFAOYSA-N
XLogP2.41
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(thiadiazol-5-yl)ethanamine
CID 105164915
2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine
CID 79756296
2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(1H-1,2,4-triazol-5-yl)ethanamine
CID 79750862
2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
CID 105007716
[2-(1-ethylbenzimidazol-2-yl)-1-thiophen-2-ylethyl]hydrazine
CID 105193559
[2-(1-ethylbenzimidazol-2-yl)-1-pyridazin-4-ylethyl]hydrazine
CID 105321121
1-(1-ethylbenzimidazol-2-yl)propan-2-ol
CID 79753828
1-ethoxy-3-(1-ethylbenzimidazol-2-yl)-N-methylpropan-2-amine
CID 79751086
1-cyclobutyl-2-(1-ethylbenzimidazol-2-yl)-N-methylethanamine
CID 79750551
1-(1-ethylbenzimidazol-2-yl)-N-methyl-3-[(2-methylpropan-2-yl)oxy]propan-2-amine
CID 105164929
N-methyl-2-(1-propylbenzimidazol-2-yl)-1-thiophen-3-ylethanamine
CID 79756302
N-ethyl-1-(1-ethylbenzimidazol-2-yl)-3-methoxypropan-2-amine
CID 79751150

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine?
The IUPAC name of 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine (CID 105164975) is 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine.
What is the SMILES notation for 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine?
The canonical SMILES for 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine is CCn1c(CC(NC)c2cnns2)nc2ccccc21.
What is the InChIKey of 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine?
The InChIKey is QWSMEBZVVQZZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5S/c1-3-19-12-7-5-4-6-10(12)17-14(19)8-11(15-2)13-9-16-18-20-13/h4-7,9,11,15H,3,8H2,1-2H3.
What are the key properties of 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine?
2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine has a molecular weight of 287.39 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine is sourced from PubChem (CID 105164975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).