1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine

C5H12ClN2P — CID 23280479

IUPAC1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine
SMILESCN(C)C(=PCl)N(C)C
InChIInChI=1S/C5H12ClN2P/c1-7(2)5(9-6)8(3)4/h1-4H3
InChIKeyDNWSKJAMJLAQHK-UHFFFAOYSA-N
MW166.59 g/mol
LogP1.30
Rot. Bonds2

About 1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine

1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine (PubChem CID 23280479) has the molecular formula C5H12ClN2P and a molecular weight of 166.59 g/mol. Its IUPAC name is 1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine.

Molecular Properties

Compound Name1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine
PubChem CID23280479
Molecular FormulaC5H12ClN2P
Molecular Weight166.59 g/mol
Exact Mass166.04
IUPAC Name1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine
SMILESCN(C)C(=PCl)N(C)C
InChIInChI=1S/C5H12ClN2P/c1-7(2)5(9-6)8(3)4/h1-4H3
InChIKeyDNWSKJAMJLAQHK-UHFFFAOYSA-N
XLogP1.30
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.59
LogP ≤ 51.30
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 1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine?
The IUPAC name of 1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine (CID 23280479) is 1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine.
What is the SMILES notation for 1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine?
The canonical SMILES for 1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine is CN(C)C(=PCl)N(C)C.
What is the InChIKey of 1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine?
The InChIKey is DNWSKJAMJLAQHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12ClN2P/c1-7(2)5(9-6)8(3)4/h1-4H3.
What are the key properties of 1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine?
1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine has a molecular weight of 166.59 g/mol, XLogP of 1.30, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chlorophosphanylidene-N,N,N',N'-tetramethylmethanediamine is sourced from PubChem (CID 23280479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).