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

C15H24N6 — CID 120970569

IUPAC1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine
SMILESCN1CCN(c2ncccc2CNC2=NCCN2C)CC1
InChIInChI=1S/C15H24N6/c1-19-8-10-21(11-9-19)14-13(4-3-5-16-14)12-18-15-17-6-7-20(15)2/h3-5H,6-12H2,1-2H3,(H,17,18)
InChIKeyCWYYNJSJMYJVPW-UHFFFAOYSA-N
MW288.40 g/mol
LogP0.22
Rot. Bonds3

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

1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine (PubChem CID 120970569) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is 1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine
PubChem CID120970569
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC Name1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine
SMILESCN1CCN(c2ncccc2CNC2=NCCN2C)CC1
InChIInChI=1S/C15H24N6/c1-19-8-10-21(11-9-19)14-13(4-3-5-16-14)12-18-15-17-6-7-20(15)2/h3-5H,6-12H2,1-2H3,(H,17,18)
InChIKeyCWYYNJSJMYJVPW-UHFFFAOYSA-N
XLogP0.22
TPSA47.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine (CID 120970569) is 1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine is CN1CCN(c2ncccc2CNC2=NCCN2C)CC1.
What is the InChIKey of 1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine?
The InChIKey is CWYYNJSJMYJVPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-19-8-10-21(11-9-19)14-13(4-3-5-16-14)12-18-15-17-6-7-20(15)2/h3-5H,6-12H2,1-2H3,(H,17,18).
What are the key properties of 1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine?
1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine has a molecular weight of 288.40 g/mol, XLogP of 0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 120970569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).