1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine

C15H17N5 — CID 58884442

IUPAC1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine
SMILESCc1nn(C)c(C)c1/N=C/c1nc2ccccc2n1C
InChIInChI=1S/C15H17N5/c1-10-15(11(2)20(4)18-10)16-9-14-17-12-7-5-6-8-13(12)19(14)3/h5-9H,1-4H3/b16-9+
InChIKeyNGKIPJLGBZDQNV-CXUHLZMHSA-N
MW267.34 g/mol
LogP2.67
Rot. Bonds2

About 1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine

1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine (PubChem CID 58884442) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is 1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine.

Molecular Properties

Compound Name1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine
PubChem CID58884442
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC Name1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine
SMILESCc1nn(C)c(C)c1/N=C/c1nc2ccccc2n1C
InChIInChI=1S/C15H17N5/c1-10-15(11(2)20(4)18-10)16-9-14-17-12-7-5-6-8-13(12)19(14)3/h5-9H,1-4H3/b16-9+
InChIKeyNGKIPJLGBZDQNV-CXUHLZMHSA-N
XLogP2.67
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine?
The IUPAC name of 1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine (CID 58884442) is 1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine.
What is the SMILES notation for 1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine?
The canonical SMILES for 1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine is Cc1nn(C)c(C)c1/N=C/c1nc2ccccc2n1C.
What is the InChIKey of 1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine?
The InChIKey is NGKIPJLGBZDQNV-CXUHLZMHSA-N. The full InChI is InChI=1S/C15H17N5/c1-10-15(11(2)20(4)18-10)16-9-14-17-12-7-5-6-8-13(12)19(14)3/h5-9H,1-4H3/b16-9+.
What are the key properties of 1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine?
1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine has a molecular weight of 267.34 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylbenzimidazol-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)methanimine is sourced from PubChem (CID 58884442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).