2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine

C17H20N4 — CID 79756296

IUPAC2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine
SMILESCCn1c(CC(NC)c2ccccn2)nc2ccccc21
InChIInChI=1S/C17H20N4/c1-3-21-16-10-5-4-9-14(16)20-17(21)12-15(18-2)13-8-6-7-11-19-13/h4-11,15,18H,3,12H2,1-2H3
InChIKeyQASFPDKHKHCISC-UHFFFAOYSA-N
MW280.38 g/mol
LogP2.95
Rot. Bonds5

About 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine

2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine (PubChem CID 79756296) has the molecular formula C17H20N4 and a molecular weight of 280.38 g/mol. Its IUPAC name is 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine.

Molecular Properties

Compound Name2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine
PubChem CID79756296
Molecular FormulaC17H20N4
Molecular Weight280.38 g/mol
Exact Mass280.17
IUPAC Name2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine
SMILESCCn1c(CC(NC)c2ccccn2)nc2ccccc21
InChIInChI=1S/C17H20N4/c1-3-21-16-10-5-4-9-14(16)20-17(21)12-15(18-2)13-8-6-7-11-19-13/h4-11,15,18H,3,12H2,1-2H3
InChIKeyQASFPDKHKHCISC-UHFFFAOYSA-N
XLogP2.95
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine
CID 79753548
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)-N-methyl-1-(thiadiazol-5-yl)ethanamine
CID 105164975
1-(1-ethylbenzimidazol-2-yl)-N-methyl-3-[(2-methylpropan-2-yl)oxy]propan-2-amine
CID 105164929
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine
CID 79750104
1-(1-ethylbenzimidazol-2-yl)propan-2-ol
CID 79753828
1-ethoxy-3-(1-ethylbenzimidazol-2-yl)-N-methylpropan-2-amine
CID 79751086
4-(1-ethylbenzimidazol-2-yl)-2,3-dimethyl-N-propan-2-ylbutan-1-amine
CID 81011531
N-ethyl-3-(1-ethylbenzimidazol-2-yl)-1,1-difluoropropan-2-amine
CID 103516859
1-cyclobutyl-2-(1-ethylbenzimidazol-2-yl)-N-methylethanamine
CID 79750551
[2-(1-ethylbenzimidazol-2-yl)-1-pyridazin-4-ylethyl]hydrazine
CID 105321121

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine?
The IUPAC name of 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine (CID 79756296) is 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine.
What is the SMILES notation for 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine?
The canonical SMILES for 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine is CCn1c(CC(NC)c2ccccn2)nc2ccccc21.
What is the InChIKey of 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine?
The InChIKey is QASFPDKHKHCISC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4/c1-3-21-16-10-5-4-9-14(16)20-17(21)12-15(18-2)13-8-6-7-11-19-13/h4-11,15,18H,3,12H2,1-2H3.
What are the key properties of 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine?
2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine has a molecular weight of 280.38 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine is sourced from PubChem (CID 79756296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).