cyclobutane;ethane;methyl(propyl)phosphane

C10H25P — CID 142075286

IUPACcyclobutane;ethane;methyl(propyl)phosphane
SMILESC1CCC1.CC.CCCPC
InChIInChI=1S/C4H11P.C4H8.C2H6/c1-3-4-5-2;1-2-4-3-1;1-2/h5H,3-4H2,1-2H3;1-4H2;1-2H3
InChIKeyBXEGZFDSFKOTFW-UHFFFAOYSA-N
MW176.28 g/mol
LogP4.29
Rot. Bonds2

About cyclobutane;ethane;methyl(propyl)phosphane

cyclobutane;ethane;methyl(propyl)phosphane (PubChem CID 142075286) has the molecular formula C10H25P and a molecular weight of 176.28 g/mol. Its IUPAC name is cyclobutane;ethane;methyl(propyl)phosphane.

Molecular Properties

Compound Namecyclobutane;ethane;methyl(propyl)phosphane
PubChem CID142075286
Molecular FormulaC10H25P
Molecular Weight176.28 g/mol
Exact Mass176.17
IUPAC Namecyclobutane;ethane;methyl(propyl)phosphane
SMILESC1CCC1.CC.CCCPC
InChIInChI=1S/C4H11P.C4H8.C2H6/c1-3-4-5-2;1-2-4-3-1;1-2/h5H,3-4H2,1-2H3;1-4H2;1-2H3
InChIKeyBXEGZFDSFKOTFW-UHFFFAOYSA-N
XLogP4.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.28
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclobutane;ethane;methyl(propyl)phosphane?
The IUPAC name of cyclobutane;ethane;methyl(propyl)phosphane (CID 142075286) is cyclobutane;ethane;methyl(propyl)phosphane.
What is the SMILES notation for cyclobutane;ethane;methyl(propyl)phosphane?
The canonical SMILES for cyclobutane;ethane;methyl(propyl)phosphane is C1CCC1.CC.CCCPC.
What is the InChIKey of cyclobutane;ethane;methyl(propyl)phosphane?
The InChIKey is BXEGZFDSFKOTFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11P.C4H8.C2H6/c1-3-4-5-2;1-2-4-3-1;1-2/h5H,3-4H2,1-2H3;1-4H2;1-2H3.
What are the key properties of cyclobutane;ethane;methyl(propyl)phosphane?
cyclobutane;ethane;methyl(propyl)phosphane has a molecular weight of 176.28 g/mol, XLogP of 4.29, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutane;ethane;methyl(propyl)phosphane is sourced from PubChem (CID 142075286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).