4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine

C13H15N5 — CID 55061195

IUPAC4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine
SMILESCc1cc2nc(-c3cnn(C)c3N)[nH]c2cc1C
InChIInChI=1S/C13H15N5/c1-7-4-10-11(5-8(7)2)17-13(16-10)9-6-15-18(3)12(9)14/h4-6H,14H2,1-3H3,(H,16,17)
InChIKeyNMFMQIZFPHUXAG-UHFFFAOYSA-N
MW241.30 g/mol
LogP2.16
Rot. Bonds1

About 4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine

4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine (PubChem CID 55061195) has the molecular formula C13H15N5 and a molecular weight of 241.30 g/mol. Its IUPAC name is 4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine
PubChem CID55061195
Molecular FormulaC13H15N5
Molecular Weight241.30 g/mol
Exact Mass241.13
IUPAC Name4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine
SMILESCc1cc2nc(-c3cnn(C)c3N)[nH]c2cc1C
InChIInChI=1S/C13H15N5/c1-7-4-10-11(5-8(7)2)17-13(16-10)9-6-15-18(3)12(9)14/h4-6H,14H2,1-3H3,(H,16,17)
InChIKeyNMFMQIZFPHUXAG-UHFFFAOYSA-N
XLogP2.16
TPSA72.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.30
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine?
The IUPAC name of 4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine (CID 55061195) is 4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine?
The canonical SMILES for 4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine is Cc1cc2nc(-c3cnn(C)c3N)[nH]c2cc1C.
What is the InChIKey of 4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine?
The InChIKey is NMFMQIZFPHUXAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5/c1-7-4-10-11(5-8(7)2)17-13(16-10)9-6-15-18(3)12(9)14/h4-6H,14H2,1-3H3,(H,16,17).
What are the key properties of 4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine?
4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine has a molecular weight of 241.30 g/mol, XLogP of 2.16, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5,6-dimethyl-1H-benzimidazol-2-yl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 55061195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).