4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine

C11H15N5 — CID 79175761

IUPAC4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine
SMILESCc1cc(NCc2nccn2C)ncc1N
InChIInChI=1S/C11H15N5/c1-8-5-10(14-6-9(8)12)15-7-11-13-3-4-16(11)2/h3-6H,7,12H2,1-2H3,(H,14,15)
InChIKeyZMMJUBYURVEBBV-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.32
Rot. Bonds3

About 4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine

4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine (PubChem CID 79175761) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine
PubChem CID79175761
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine
SMILESCc1cc(NCc2nccn2C)ncc1N
InChIInChI=1S/C11H15N5/c1-8-5-10(14-6-9(8)12)15-7-11-13-3-4-16(11)2/h3-6H,7,12H2,1-2H3,(H,14,15)
InChIKeyZMMJUBYURVEBBV-UHFFFAOYSA-N
XLogP1.32
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine
CID 63295615
5-bromo-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,3-diamine
CID 63293701
4-bromo-2,6-dimethyl-N-[(1-methylimidazol-2-yl)methyl]aniline
CID 43142883
4-methyl-2-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2,5-diamine
CID 79175930
2,3-dimethyl-4-N-[(1-methylimidazol-2-yl)methyl]benzene-1,4-diamine
CID 138489685
2-chloro-6-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 63294630
4-N-[(1-methylimidazol-2-yl)methyl]-2-propan-2-ylpyrimidine-4,6-diamine
CID 80957408
5-amino-6-[(1-methylimidazol-2-yl)methylamino]pyridine-3-carbonitrile
CID 103468425
N-[(1-methylimidazol-2-yl)methyl]-5-(trifluoromethyl)pyridin-2-amine
CID 63295527
6-hydrazinyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine
CID 80913707
6-chloro-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
CID 63294100
3-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
CID 83062959

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine?
The IUPAC name of 4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine (CID 79175761) is 4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine.
What is the SMILES notation for 4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine?
The canonical SMILES for 4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine is Cc1cc(NCc2nccn2C)ncc1N.
What is the InChIKey of 4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine?
The InChIKey is ZMMJUBYURVEBBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-8-5-10(14-6-9(8)12)15-7-11-13-3-4-16(11)2/h3-6H,7,12H2,1-2H3,(H,14,15).
What are the key properties of 4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine?
4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine has a molecular weight of 217.28 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine is sourced from PubChem (CID 79175761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).