2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine

C11H17N5 — CID 136847536

IUPAC2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine
SMILESCC(C)C(N)c1ncc(-c2ccnn2C)[nH]1
InChIInChI=1S/C11H17N5/c1-7(2)10(12)11-13-6-8(15-11)9-4-5-14-16(9)3/h4-7,10H,12H2,1-3H3,(H,13,15)
InChIKeyUIQWUVAZNHBCLL-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.47
Rot. Bonds3

About 2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine

2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine (PubChem CID 136847536) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is 2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine
PubChem CID136847536
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC Name2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine
SMILESCC(C)C(N)c1ncc(-c2ccnn2C)[nH]1
InChIInChI=1S/C11H17N5/c1-7(2)10(12)11-13-6-8(15-11)9-4-5-14-16(9)3/h4-7,10H,12H2,1-3H3,(H,13,15)
InChIKeyUIQWUVAZNHBCLL-UHFFFAOYSA-N
XLogP1.47
TPSA72.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine?
The IUPAC name of 2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine (CID 136847536) is 2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine.
What is the SMILES notation for 2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine?
The canonical SMILES for 2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine is CC(C)C(N)c1ncc(-c2ccnn2C)[nH]1.
What is the InChIKey of 2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine?
The InChIKey is UIQWUVAZNHBCLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-7(2)10(12)11-13-6-8(15-11)9-4-5-14-16(9)3/h4-7,10H,12H2,1-3H3,(H,13,15).
What are the key properties of 2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine?
2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine has a molecular weight of 219.29 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[5-(2-methylpyrazol-3-yl)-1H-imidazol-2-yl]propan-1-amine is sourced from PubChem (CID 136847536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).