dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane

C10H23N2P — CID 154936752

IUPACdimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane
SMILESCN1CCN(CCCP(C)C)CC1
InChIInChI=1S/C10H23N2P/c1-11-6-8-12(9-7-11)5-4-10-13(2)3/h4-10H2,1-3H3
InChIKeyIKUWVOMYTJHYGZ-UHFFFAOYSA-N
MW202.28 g/mol
LogP1.37
Rot. Bonds4

About dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane

dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane (PubChem CID 154936752) has the molecular formula C10H23N2P and a molecular weight of 202.28 g/mol. Its IUPAC name is dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane.

Molecular Properties

Compound Namedimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane
PubChem CID154936752
Molecular FormulaC10H23N2P
Molecular Weight202.28 g/mol
Exact Mass202.16
IUPAC Namedimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane
SMILESCN1CCN(CCCP(C)C)CC1
InChIInChI=1S/C10H23N2P/c1-11-6-8-12(9-7-11)5-4-10-13(2)3/h4-10H2,1-3H3
InChIKeyIKUWVOMYTJHYGZ-UHFFFAOYSA-N
XLogP1.37
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.28
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane?
The IUPAC name of dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane (CID 154936752) is dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane.
What is the SMILES notation for dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane?
The canonical SMILES for dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane is CN1CCN(CCCP(C)C)CC1.
What is the InChIKey of dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane?
The InChIKey is IKUWVOMYTJHYGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N2P/c1-11-6-8-12(9-7-11)5-4-10-13(2)3/h4-10H2,1-3H3.
What are the key properties of dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane?
dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane has a molecular weight of 202.28 g/mol, XLogP of 1.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[3-(4-methylpiperazin-1-yl)propyl]phosphane is sourced from PubChem (CID 154936752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).