[1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane

C16H24FP — CID 156542653

IUPAC[1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane
SMILESCCCC(c1ccccc1)C1CCC(F)(P)CC1
InChIInChI=1S/C16H24FP/c1-2-6-15(13-7-4-3-5-8-13)14-9-11-16(17,18)12-10-14/h3-5,7-8,14-15H,2,6,9-12,18H2,1H3
InChIKeyNYARIZUNCPWNCH-UHFFFAOYSA-N
MW266.34 g/mol
LogP5.30
Rot. Bonds4

About [1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane

[1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane (PubChem CID 156542653) has the molecular formula C16H24FP and a molecular weight of 266.34 g/mol. Its IUPAC name is [1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane.

Molecular Properties

Compound Name[1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane
PubChem CID156542653
Molecular FormulaC16H24FP
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name[1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane
SMILESCCCC(c1ccccc1)C1CCC(F)(P)CC1
InChIInChI=1S/C16H24FP/c1-2-6-15(13-7-4-3-5-8-13)14-9-11-16(17,18)12-10-14/h3-5,7-8,14-15H,2,6,9-12,18H2,1H3
InChIKeyNYARIZUNCPWNCH-UHFFFAOYSA-N
XLogP5.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.34
LogP ≤ 55.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-cyclobutylpentylbenzene
CID 90897767
(2R)-2-(4,4-dimethylcyclohexyl)-2-phenylethanamine
CID 121454644
3-cyclopropyl-3-phenylpropan-1-ol
CID 19754835
(2-bromo-1-cyclopropylethyl)benzene
CID 57168506
3-cyclopentyl-3-phenylpropan-1-ol
CID 57047034
1-[(1R)-1-(4,4-dimethylcyclohexyl)-3-methylbutyl]-4-phenylbenzene
CID 145116245
cyclobutane;1-cyclohex-2-en-1-ylbutylbenzene
CID 145163043
(2-cyclopentyl-2-phenylethyl)phosphane
CID 57243650
4-(1-phenylpropyl)oxane
CID 155461106
2-cyclopropyl-2-phenylethanamine;hydrochloride
CID 57365234
1-cyclohexylpentan-2-ylbenzene
CID 139744385
4-(4-methoxy-1-phenylbutyl)piperidin-1-amine
CID 174726761

Frequently Asked Questions

What is the IUPAC name of [1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane?
The IUPAC name of [1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane (CID 156542653) is [1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane.
What is the SMILES notation for [1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane?
The canonical SMILES for [1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane is CCCC(c1ccccc1)C1CCC(F)(P)CC1.
What is the InChIKey of [1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane?
The InChIKey is NYARIZUNCPWNCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FP/c1-2-6-15(13-7-4-3-5-8-13)14-9-11-16(17,18)12-10-14/h3-5,7-8,14-15H,2,6,9-12,18H2,1H3.
What are the key properties of [1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane?
[1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane has a molecular weight of 266.34 g/mol, XLogP of 5.30, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-fluoro-4-(1-phenylbutyl)cyclohexyl]phosphane is sourced from PubChem (CID 156542653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).