(1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine

C15H16N4 — CID 103937579

IUPAC(1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine
SMILESCC[C@@H](N)c1ccc(-n2cnc3ccccc32)cn1
InChIInChI=1S/C15H16N4/c1-2-12(16)13-8-7-11(9-17-13)19-10-18-14-5-3-4-6-15(14)19/h3-10,12H,2,16H2,1H3/t12-/m1/s1
InChIKeyJXGLGHUHYPFAJQ-GFCCVEGCSA-N
MW252.32 g/mol
LogP2.83
Rot. Bonds3

About (1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine

(1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine (PubChem CID 103937579) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is (1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine.

Molecular Properties

Compound Name(1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine
PubChem CID103937579
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name(1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine
SMILESCC[C@@H](N)c1ccc(-n2cnc3ccccc32)cn1
InChIInChI=1S/C15H16N4/c1-2-12(16)13-8-7-11(9-17-13)19-10-18-14-5-3-4-6-15(14)19/h3-10,12H,2,16H2,1H3/t12-/m1/s1
InChIKeyJXGLGHUHYPFAJQ-GFCCVEGCSA-N
XLogP2.83
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-ol
CID 112585509
1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]imidazole-4,5-dicarbonitrile
CID 103940293
1-[6-[(1S)-1-aminopropyl]-3-pyridinyl]imidazole-4,5-dicarbonitrile
CID 103940288
(1S)-1-[4-(benzimidazol-1-yl)phenyl]ethanamine
CID 25324450
1-[4-(benzimidazol-1-yl)phenyl]propan-2-amine
CID 55237590
1-(4-ethoxyphenyl)benzimidazole
CID 175001446
6-[(1R)-1-aminopropyl]pyridin-3-ol
CID 55276418
(1S)-1-[5-(3,4-dimethylpyrrolidin-1-yl)-2-pyridinyl]propan-1-amine
CID 113355142
(1R)-1-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]propan-1-amine
CID 113355072
1-[6-(1H-1,2,4-triazol-5-yl)-3-pyridinyl]benzimidazole
CID 175588349
1-[1-[6-(1-aminopropyl)-3-pyridinyl]piperidin-4-yl]ethanol
CID 106836278
4-(benzimidazol-1-yl)-N-butan-2-ylbenzamide
CID 24624881

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine?
The IUPAC name of (1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine (CID 103937579) is (1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine.
What is the SMILES notation for (1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine?
The canonical SMILES for (1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine is CC[C@@H](N)c1ccc(-n2cnc3ccccc32)cn1.
What is the InChIKey of (1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine?
The InChIKey is JXGLGHUHYPFAJQ-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H16N4/c1-2-12(16)13-8-7-11(9-17-13)19-10-18-14-5-3-4-6-15(14)19/h3-10,12H,2,16H2,1H3/t12-/m1/s1.
What are the key properties of (1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine?
(1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine has a molecular weight of 252.32 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-(benzimidazol-1-yl)-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 103937579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).