[6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine

C13H16N4 — CID 62252730

IUPAC[6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine
SMILESCc1cc(NN)nc(Cc2ccccc2C)n1
InChIInChI=1S/C13H16N4/c1-9-5-3-4-6-11(9)8-12-15-10(2)7-13(16-12)17-14/h3-7H,8,14H2,1-2H3,(H,15,16,17)
InChIKeyFMDKYCPBTOGMLE-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.97
Rot. Bonds3

About [6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine

[6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine (PubChem CID 62252730) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is [6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine
PubChem CID62252730
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name[6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine
SMILESCc1cc(NN)nc(Cc2ccccc2C)n1
InChIInChI=1S/C13H16N4/c1-9-5-3-4-6-11(9)8-12-15-10(2)7-13(16-12)17-14/h3-7H,8,14H2,1-2H3,(H,15,16,17)
InChIKeyFMDKYCPBTOGMLE-UHFFFAOYSA-N
XLogP1.97
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,6-dimethyl-2-[(2-methylphenyl)methyl]pyrimidin-4-amine
CID 55135005
[2-[(2-methylphenyl)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62252014
[5,6-dimethyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine
CID 62250532
[2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine
CID 62251604
1-(2-chlorophenyl)-N-[(4-hydrazinyl-6-methylpyrimidin-2-yl)methyl]-N-methylmethanamine
CID 80655140
6-hydrazinyl-2-methyl-N-[(2-methylphenyl)methyl]pyrimidin-4-amine
CID 80898136
4-methyl-2-[(2-methylphenyl)methyl]pyrimidine
CID 21028246
6-(methoxymethyl)-N-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-amine
CID 55062684
[6-methyl-2-[(2-propoxyphenoxy)methyl]pyrimidin-4-yl]hydrazine
CID 80664443
[2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine
CID 65092426
3-[4,6-dimethyl-2-[(2-methylphenyl)methyl]pyrimidin-5-yl]propan-1-amine
CID 62744192
N-ethyl-6-methyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]pyrimidin-4-amine
CID 80657417

Frequently Asked Questions

What is the IUPAC name of [6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine (CID 62252730) is [6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine is Cc1cc(NN)nc(Cc2ccccc2C)n1.
What is the InChIKey of [6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine?
The InChIKey is FMDKYCPBTOGMLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-9-5-3-4-6-11(9)8-12-15-10(2)7-13(16-12)17-14/h3-7H,8,14H2,1-2H3,(H,15,16,17).
What are the key properties of [6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine?
[6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine has a molecular weight of 228.30 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62252730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).