(4-fluoro-1-methylpiperidin-4-yl)-methylphosphane

C7H15FNP — CID 134365981

IUPAC(4-fluoro-1-methylpiperidin-4-yl)-methylphosphane
SMILESCPC1(F)CCN(C)CC1
InChIInChI=1S/C7H15FNP/c1-9-5-3-7(8,10-2)4-6-9/h10H,3-6H2,1-2H3
InChIKeyPBZQJBVELQRHNS-UHFFFAOYSA-N
MW163.18 g/mol
LogP1.69
Rot. Bonds1

About (4-fluoro-1-methylpiperidin-4-yl)-methylphosphane

(4-fluoro-1-methylpiperidin-4-yl)-methylphosphane (PubChem CID 134365981) has the molecular formula C7H15FNP and a molecular weight of 163.18 g/mol. Its IUPAC name is (4-fluoro-1-methylpiperidin-4-yl)-methylphosphane.

Molecular Properties

Compound Name(4-fluoro-1-methylpiperidin-4-yl)-methylphosphane
PubChem CID134365981
Molecular FormulaC7H15FNP
Molecular Weight163.18 g/mol
Exact Mass163.09
IUPAC Name(4-fluoro-1-methylpiperidin-4-yl)-methylphosphane
SMILESCPC1(F)CCN(C)CC1
InChIInChI=1S/C7H15FNP/c1-9-5-3-7(8,10-2)4-6-9/h10H,3-6H2,1-2H3
InChIKeyPBZQJBVELQRHNS-UHFFFAOYSA-N
XLogP1.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

(4-fluoro-1-methylpiperidin-4-yl)methanol
CID 24729611
4-ethenyl-4-fluoro-1-methylpiperidine
CID 154558777
4,4-difluoro-1-methylpiperidine;ethane;ethanol
CID 166533902
1,4-dimethylpiperazine;ethane
CID 91292414
4-(2,3-dimethylbutyl)-4-fluoro-1-methylpiperidine
CID 134373431
4-(fluoromethyl)-1-methylpiperidine-4-carboxylic acid
CID 83816581
3-fluoro-9-methyl-3,9-diazaspiro[5.5]undecane
CID 156707007
1,4,4,5,5,6,6-heptamethylazocane
CID 154547970
(3R)-4,4-difluoro-1-methylpiperidin-3-amine
CID 170923047
N,1-dimethyl-4-(trifluoromethyl)piperidin-4-amine
CID 66206567
(1R,5S)-8-[(4-fluoro-1-methylpiperidin-4-yl)methyl]-3-methyl-8-azabicyclo[3.2.1]octane
CID 176562394
1,4-dimethyl-4-propan-2-ylpiperidine;ethane
CID 142456453

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-1-methylpiperidin-4-yl)-methylphosphane?
The IUPAC name of (4-fluoro-1-methylpiperidin-4-yl)-methylphosphane (CID 134365981) is (4-fluoro-1-methylpiperidin-4-yl)-methylphosphane.
What is the SMILES notation for (4-fluoro-1-methylpiperidin-4-yl)-methylphosphane?
The canonical SMILES for (4-fluoro-1-methylpiperidin-4-yl)-methylphosphane is CPC1(F)CCN(C)CC1.
What is the InChIKey of (4-fluoro-1-methylpiperidin-4-yl)-methylphosphane?
The InChIKey is PBZQJBVELQRHNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FNP/c1-9-5-3-7(8,10-2)4-6-9/h10H,3-6H2,1-2H3.
What are the key properties of (4-fluoro-1-methylpiperidin-4-yl)-methylphosphane?
(4-fluoro-1-methylpiperidin-4-yl)-methylphosphane has a molecular weight of 163.18 g/mol, XLogP of 1.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-1-methylpiperidin-4-yl)-methylphosphane is sourced from PubChem (CID 134365981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).