1-(4-fluorophenyl)-2-methyldiazinane

C11H15FN2 — CID 59602817

IUPAC1-(4-fluorophenyl)-2-methyldiazinane
SMILESCN1CCCCN1c1ccc(F)cc1
InChIInChI=1S/C11H15FN2/c1-13-8-2-3-9-14(13)11-6-4-10(12)5-7-11/h4-7H,2-3,8-9H2,1H3
InChIKeyCCUJGYUZQQBPJN-UHFFFAOYSA-N
MW194.25 g/mol
LogP2.27
Rot. Bonds1

About 1-(4-fluorophenyl)-2-methyldiazinane

1-(4-fluorophenyl)-2-methyldiazinane (PubChem CID 59602817) has the molecular formula C11H15FN2 and a molecular weight of 194.25 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-methyldiazinane.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-methyldiazinane
PubChem CID59602817
Molecular FormulaC11H15FN2
Molecular Weight194.25 g/mol
Exact Mass194.12
IUPAC Name1-(4-fluorophenyl)-2-methyldiazinane
SMILESCN1CCCCN1c1ccc(F)cc1
InChIInChI=1S/C11H15FN2/c1-13-8-2-3-9-14(13)11-6-4-10(12)5-7-11/h4-7H,2-3,8-9H2,1H3
InChIKeyCCUJGYUZQQBPJN-UHFFFAOYSA-N
XLogP2.27
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-2-methylpyrazolidine
CID 59602837
1-(2,4-difluorophenyl)-2-methyldiazinane
CID 59602841
1-(2,4-difluorophenyl)-2-methylpyrazolidine
CID 59602822
2-(4-fluorophenyl)-1,5-dimethyl-3H-pyrazole
CID 150439105
2-(4-fluorophenyl)-1-methyl-3H-1,2,4-triazole
CID 142798426
ethane;1-(4-fluorophenyl)-4-propan-2-ylpiperazine
CID 144656780
1-(4-fluorophenyl)-4,6-dimethyl-1,5-diazocane
CID 54973091
1-[4-(4-fluorophenyl)sulfonylphenyl]-4-methylpiperazine
CID 141044251
ethane;1-(4-fluorophenyl)-1,4-diazepane
CID 168950071
1,3-bis(4-fluorophenyl)-2-methyl-1,3,2λ5-diazaphospholidine 2-oxide
CID 159663029
4-(4-fluorophenyl)-1,1-dimethylpiperazin-1-ium
CID 10903809
4-fluorobenzonitrile;4-piperidin-1-ylbenzonitrile
CID 158355573

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-methyldiazinane?
The IUPAC name of 1-(4-fluorophenyl)-2-methyldiazinane (CID 59602817) is 1-(4-fluorophenyl)-2-methyldiazinane.
What is the SMILES notation for 1-(4-fluorophenyl)-2-methyldiazinane?
The canonical SMILES for 1-(4-fluorophenyl)-2-methyldiazinane is CN1CCCCN1c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-methyldiazinane?
The InChIKey is CCUJGYUZQQBPJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2/c1-13-8-2-3-9-14(13)11-6-4-10(12)5-7-11/h4-7H,2-3,8-9H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-methyldiazinane?
1-(4-fluorophenyl)-2-methyldiazinane has a molecular weight of 194.25 g/mol, XLogP of 2.27, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-methyldiazinane is sourced from PubChem (CID 59602817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).