6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine

C19H17N5 — CID 129086038

IUPAC6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine
SMILESc1cc(NCCc2ccncc2)nc(-n2cnc3ccccc32)c1
InChIInChI=1S/C19H17N5/c1-2-5-17-16(4-1)22-14-24(17)19-7-3-6-18(23-19)21-13-10-15-8-11-20-12-9-15/h1-9,11-12,14H,10,13H2,(H,21,23)
InChIKeyLXOPXNJLPKCVBS-UHFFFAOYSA-N
MW315.38 g/mol
LogP3.47
Rot. Bonds5

About 6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine

6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine (PubChem CID 129086038) has the molecular formula C19H17N5 and a molecular weight of 315.38 g/mol. Its IUPAC name is 6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine
PubChem CID129086038
Molecular FormulaC19H17N5
Molecular Weight315.38 g/mol
Exact Mass315.15
IUPAC Name6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine
SMILESc1cc(NCCc2ccncc2)nc(-n2cnc3ccccc32)c1
InChIInChI=1S/C19H17N5/c1-2-5-17-16(4-1)22-14-24(17)19-7-3-6-18(23-19)21-13-10-15-8-11-20-12-9-15/h1-9,11-12,14H,10,13H2,(H,21,23)
InChIKeyLXOPXNJLPKCVBS-UHFFFAOYSA-N
XLogP3.47
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[[6-(benzimidazol-1-yl)-2-pyridinyl]amino]-N,2,2-trimethylpropanamide
CID 154781024
4-(benzimidazol-1-yl)-5-[(methylideneamino)methyl]-N-(2-pyridin-4-ylethyl)pyrimidin-2-amine
CID 155346668
4-(5-methylbenzimidazol-1-yl)-N-(2-phenylethyl)pyrimidin-2-amine
CID 70111772
4-(benzimidazol-1-yl)-N-ethylpyrimidin-2-amine
CID 80854162
N-(2-phenylethyl)-4-(5-pyrimidin-5-ylbenzimidazol-1-yl)pyrimidin-2-amine
CID 70112792
2-hydrazinyl-N-(2-pyridin-4-ylethyl)pyrimidin-4-amine
CID 80899162
2-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)propanamide
CID 75679386
4-(benzimidazol-1-yl)-N-[(4-methylphenyl)methyl]pyrimidin-2-amine
CID 18375779
6-(benzimidazol-1-yl)-N-propylpyrimidin-4-amine
CID 80853526
N'-[4-(benzimidazol-1-yl)pyrimidin-2-yl]-N-(5-nitro-2-pyridinyl)ethane-1,2-diamine
CID 129086145
4-(benzimidazol-1-yl)-2-(2-pyridin-4-ylethoxy)pyrimidine-5-carbonitrile
CID 140903638
1-(2-methylpyrimidin-4-yl)benzimidazole
CID 112695167

Frequently Asked Questions

What is the IUPAC name of 6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine?
The IUPAC name of 6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine (CID 129086038) is 6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine.
What is the SMILES notation for 6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine?
The canonical SMILES for 6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine is c1cc(NCCc2ccncc2)nc(-n2cnc3ccccc32)c1.
What is the InChIKey of 6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine?
The InChIKey is LXOPXNJLPKCVBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5/c1-2-5-17-16(4-1)22-14-24(17)19-7-3-6-18(23-19)21-13-10-15-8-11-20-12-9-15/h1-9,11-12,14H,10,13H2,(H,21,23).
What are the key properties of 6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine?
6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine has a molecular weight of 315.38 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(benzimidazol-1-yl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine is sourced from PubChem (CID 129086038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).