N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine

C15H20N6 — CID 120969794

IUPACN-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine
SMILESCc1cc(C)n(-c2ccc(CNC3=NCCN3C)cn2)n1
InChIInChI=1S/C15H20N6/c1-11-8-12(2)21(19-11)14-5-4-13(9-17-14)10-18-15-16-6-7-20(15)3/h4-5,8-9H,6-7,10H2,1-3H3,(H,16,18)
InChIKeyIJDKLTQCSPZUMV-UHFFFAOYSA-N
MW284.37 g/mol
LogP1.28
Rot. Bonds3

About N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine

N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine (PubChem CID 120969794) has the molecular formula C15H20N6 and a molecular weight of 284.37 g/mol. Its IUPAC name is N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound NameN-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine
PubChem CID120969794
Molecular FormulaC15H20N6
Molecular Weight284.37 g/mol
Exact Mass284.17
IUPAC NameN-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine
SMILESCc1cc(C)n(-c2ccc(CNC3=NCCN3C)cn2)n1
InChIInChI=1S/C15H20N6/c1-11-8-12(2)21(19-11)14-5-4-13(9-17-14)10-18-15-16-6-7-20(15)3/h4-5,8-9H,6-7,10H2,1-3H3,(H,16,18)
InChIKeyIJDKLTQCSPZUMV-UHFFFAOYSA-N
XLogP1.28
TPSA58.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine (CID 120969794) is N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine is Cc1cc(C)n(-c2ccc(CNC3=NCCN3C)cn2)n1.
What is the InChIKey of N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
The InChIKey is IJDKLTQCSPZUMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6/c1-11-8-12(2)21(19-11)14-5-4-13(9-17-14)10-18-15-16-6-7-20(15)3/h4-5,8-9H,6-7,10H2,1-3H3,(H,16,18).
What are the key properties of N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine has a molecular weight of 284.37 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 120969794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).