1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine

C15H19N5 — CID 105158489

IUPAC1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine
SMILESCc1cc(CC(N)Cn2cnc3ccccc32)n(C)n1
InChIInChI=1S/C15H19N5/c1-11-7-13(19(2)18-11)8-12(16)9-20-10-17-14-5-3-4-6-15(14)20/h3-7,10,12H,8-9,16H2,1-2H3
InChIKeyVZZXCNRAWZMPNZ-UHFFFAOYSA-N
MW269.35 g/mol
LogP1.65
Rot. Bonds4

About 1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine

1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine (PubChem CID 105158489) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is 1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine.

Molecular Properties

Compound Name1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine
PubChem CID105158489
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC Name1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine
SMILESCc1cc(CC(N)Cn2cnc3ccccc32)n(C)n1
InChIInChI=1S/C15H19N5/c1-11-7-13(19(2)18-11)8-12(16)9-20-10-17-14-5-3-4-6-15(14)20/h3-7,10,12H,8-9,16H2,1-2H3
InChIKeyVZZXCNRAWZMPNZ-UHFFFAOYSA-N
XLogP1.65
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(benzimidazol-1-yl)-3-(2-methyl-1,2,4-triazol-3-yl)propan-2-amine
CID 105159359
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CID 105107290
1-(benzimidazol-1-yl)hexan-2-amine
CID 105125140
1-(benzimidazol-1-yl)-4-ethylhexan-2-amine
CID 105176644
1-(benzimidazol-1-yl)-3-(5-ethyl-2-pyridinyl)propan-2-amine
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1-(benzimidazol-1-yl)pent-4-en-2-amine
CID 105107781
1-(benzimidazol-1-yl)hept-5-yn-2-amine
CID 105181339
1-(benzimidazol-1-yl)propan-2-ol
CID 22504258
1-(benzimidazol-1-yl)-4-(1-methylpyrazol-4-yl)butan-2-amine
CID 103029759
2-(benzimidazol-1-yl)-1-(3-fluoro-5-methylphenyl)ethanamine
CID 105169896
1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-yloxypropan-2-amine
CID 105158554
3-(benzimidazol-1-yl)-2-methylpropanamide
CID 112688309

Frequently Asked Questions

What is the IUPAC name of 1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine?
The IUPAC name of 1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine (CID 105158489) is 1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine.
What is the SMILES notation for 1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine?
The canonical SMILES for 1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine is Cc1cc(CC(N)Cn2cnc3ccccc32)n(C)n1.
What is the InChIKey of 1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine?
The InChIKey is VZZXCNRAWZMPNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c1-11-7-13(19(2)18-11)8-12(16)9-20-10-17-14-5-3-4-6-15(14)20/h3-7,10,12H,8-9,16H2,1-2H3.
What are the key properties of 1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine?
1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine has a molecular weight of 269.35 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzimidazol-1-yl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-amine is sourced from PubChem (CID 105158489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).