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

C16H18N4 — CID 79753548

IUPAC2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine
SMILESCCn1c(CC(N)c2ccccn2)nc2ccccc21
InChIInChI=1S/C16H18N4/c1-2-20-15-9-4-3-8-14(15)19-16(20)11-12(17)13-7-5-6-10-18-13/h3-10,12H,2,11,17H2,1H3
InChIKeyAXHCCRHTTNIMPL-UHFFFAOYSA-N
MW266.35 g/mol
LogP2.69
Rot. Bonds4

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

2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine (PubChem CID 79753548) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine.

Molecular Properties

Compound Name2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine
PubChem CID79753548
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine
SMILESCCn1c(CC(N)c2ccccn2)nc2ccccc21
InChIInChI=1S/C16H18N4/c1-2-20-15-9-4-3-8-14(15)19-16(20)11-12(17)13-7-5-6-10-18-13/h3-10,12H,2,11,17H2,1H3
InChIKeyAXHCCRHTTNIMPL-UHFFFAOYSA-N
XLogP2.69
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine
CID 79756296
2-(1-ethylbenzimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine
CID 79756634
2-(1-propylbenzimidazol-2-yl)-1-pyrimidin-2-ylethanamine
CID 79756292
1-(5-bromofuran-2-yl)-2-(1-ethylbenzimidazol-2-yl)ethanamine
CID 105007761
1-(1-ethylbenzimidazol-2-yl)propan-2-ol
CID 79753828
2-(1-ethylbenzimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)ethanol
CID 115527844
(1-ethylbenzimidazol-2-yl)methylazanium chloride
CID 139581059
4-ethoxy-1-(1-ethylbenzimidazol-2-yl)butan-2-amine
CID 105164972
2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-2-ylethanamine
CID 79753296
1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4,4-dimethylpentan-2-amine
CID 116724283
3-[2-(1-ethylbenzimidazol-2-yl)ethyl]pyridin-2-amine
CID 79750873
1-(1-ethylbenzimidazol-2-yl)-4-methoxybutan-2-ol
CID 79754353

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine?
The IUPAC name of 2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine (CID 79753548) is 2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine.
What is the SMILES notation for 2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine?
The canonical SMILES for 2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine is CCn1c(CC(N)c2ccccn2)nc2ccccc21.
What is the InChIKey of 2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine?
The InChIKey is AXHCCRHTTNIMPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-2-20-15-9-4-3-8-14(15)19-16(20)11-12(17)13-7-5-6-10-18-13/h3-10,12H,2,11,17H2,1H3.
What are the key properties of 2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine?
2-(1-ethylbenzimidazol-2-yl)-1-pyridin-2-ylethanamine has a molecular weight of 266.35 g/mol, XLogP of 2.69, 4 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)-1-pyridin-2-ylethanamine is sourced from PubChem (CID 79753548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).