1-(2,4-difluorophenyl)-2-methyldiazinane

C11H14F2N2 — CID 59602841

IUPAC1-(2,4-difluorophenyl)-2-methyldiazinane
SMILESCN1CCCCN1c1ccc(F)cc1F
InChIInChI=1S/C11H14F2N2/c1-14-6-2-3-7-15(14)11-5-4-9(12)8-10(11)13/h4-5,8H,2-3,6-7H2,1H3
InChIKeyMCXIGKFQONSRJN-UHFFFAOYSA-N
MW212.24 g/mol
LogP2.41
Rot. Bonds1

About 1-(2,4-difluorophenyl)-2-methyldiazinane

1-(2,4-difluorophenyl)-2-methyldiazinane (PubChem CID 59602841) has the molecular formula C11H14F2N2 and a molecular weight of 212.24 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-2-methyldiazinane.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-2-methyldiazinane
PubChem CID59602841
Molecular FormulaC11H14F2N2
Molecular Weight212.24 g/mol
Exact Mass212.11
IUPAC Name1-(2,4-difluorophenyl)-2-methyldiazinane
SMILESCN1CCCCN1c1ccc(F)cc1F
InChIInChI=1S/C11H14F2N2/c1-14-6-2-3-7-15(14)11-5-4-9(12)8-10(11)13/h4-5,8H,2-3,6-7H2,1H3
InChIKeyMCXIGKFQONSRJN-UHFFFAOYSA-N
XLogP2.41
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.24
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-difluorophenyl)-2-methylpyrazolidine
CID 59602822
1-(4-fluorophenyl)-2-methyldiazinane
CID 59602817
1-(4-fluorophenyl)-2-methylpyrazolidine
CID 59602837
1-(2,4-difluorophenyl)-4-propan-2-ylpiperazine
CID 20613804
1-(2,4-difluorophenyl)piperazin-4-ium
CID 7004236
1-(2,4-difluorophenyl)-3,3-dimethyl-1,4-diazepane
CID 64943692
2,4-difluoro-1-propan-2-ylbenzene;methane;1-propan-2-ylpyrrolidine;yttrium
CID 159762366
1-(2,4-difluorophenyl)piperazine;pyrrolidine
CID 143374840
1-(2,4-difluorophenyl)-4-methylpiperidine-2,6-dione
CID 2732328
1-(2,5-difluorophenyl)piperidine
CID 22638080
1-(4-fluoro-2-methylphenyl)piperidine;methanol
CID 159526986
1-deuterio-4-(2,4-difluorophenyl)piperazine
CID 175828610

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-2-methyldiazinane?
The IUPAC name of 1-(2,4-difluorophenyl)-2-methyldiazinane (CID 59602841) is 1-(2,4-difluorophenyl)-2-methyldiazinane.
What is the SMILES notation for 1-(2,4-difluorophenyl)-2-methyldiazinane?
The canonical SMILES for 1-(2,4-difluorophenyl)-2-methyldiazinane is CN1CCCCN1c1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)-2-methyldiazinane?
The InChIKey is MCXIGKFQONSRJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2/c1-14-6-2-3-7-15(14)11-5-4-9(12)8-10(11)13/h4-5,8H,2-3,6-7H2,1H3.
What are the key properties of 1-(2,4-difluorophenyl)-2-methyldiazinane?
1-(2,4-difluorophenyl)-2-methyldiazinane has a molecular weight of 212.24 g/mol, XLogP of 2.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-2-methyldiazinane is sourced from PubChem (CID 59602841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).