dimethyl(propyl)phosphane

C5H13P — CID 6396515

IUPACdimethyl(propyl)phosphane
SMILESCCCP(C)C
InChIInChI=1S/C5H13P/c1-4-5-6(2)3/h4-5H2,1-3H3
InChIKeyQVTPAZHGNYBKHE-UHFFFAOYSA-N
MW104.13 g/mol
LogP2.14
Rot. Bonds2

About dimethyl(propyl)phosphane

dimethyl(propyl)phosphane (PubChem CID 6396515) has the molecular formula C5H13P and a molecular weight of 104.13 g/mol. Its IUPAC name is dimethyl(propyl)phosphane.

Molecular Properties

Compound Namedimethyl(propyl)phosphane
PubChem CID6396515
Molecular FormulaC5H13P
Molecular Weight104.13 g/mol
Exact Mass104.08
IUPAC Namedimethyl(propyl)phosphane
SMILESCCCP(C)C
InChIInChI=1S/C5H13P/c1-4-5-6(2)3/h4-5H2,1-3H3
InChIKeyQVTPAZHGNYBKHE-UHFFFAOYSA-N
XLogP2.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.13
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze dimethyl(propyl)phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

heptyl(dimethyl)phosphane
CID 18386855
hexadecyl(dimethyl)phosphane;hydrochloride
CID 173426692
tetrakis(dodecyl(dimethyl)phosphane);nickel
CID 161299550
methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide
CID 173222667
ethyl(dimethyl)phosphane
CID 535207
butane;sulfane
CID 162203569
bis(tripropylphosphane);zirconium(2+);tetrachloride
CID 23286584
diethyl(propyl)phosphane
CID 19828866
nickel(2+);bis(tripropylphosphane);dichloride
CID 173106713
bis(2-dimethylphosphanylethyl(dimethyl)phosphane);fluororuthenium;hydrofluoride
CID 10917198
bis(2-dimethylphosphanylethyl(dimethyl)phosphane) ditetrafluoroborate
CID 173421683
dipropylphosphanylmethyl(dipropyl)phosphane
CID 23420802

Frequently Asked Questions

What is the IUPAC name of dimethyl(propyl)phosphane?
The IUPAC name of dimethyl(propyl)phosphane (CID 6396515) is dimethyl(propyl)phosphane.
What is the SMILES notation for dimethyl(propyl)phosphane?
The canonical SMILES for dimethyl(propyl)phosphane is CCCP(C)C.
What is the InChIKey of dimethyl(propyl)phosphane?
The InChIKey is QVTPAZHGNYBKHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13P/c1-4-5-6(2)3/h4-5H2,1-3H3.
What are the key properties of dimethyl(propyl)phosphane?
dimethyl(propyl)phosphane has a molecular weight of 104.13 g/mol, XLogP of 2.14, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl(propyl)phosphane is sourced from PubChem (CID 6396515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).