3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile

C15H32N3P — CID 15160604

IUPAC3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile
SMILESCC(C)N(C(C)C)P(CCC#N)N(C(C)C)C(C)C
InChIInChI=1S/C15H32N3P/c1-12(2)17(13(3)4)19(11-9-10-16)18(14(5)6)15(7)8/h12-15H,9,11H2,1-8H3
InChIKeyFZQDHMFHGFAKMY-UHFFFAOYSA-N
MW285.42 g/mol
LogP4.45
Rot. Bonds8

About 3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile

3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile (PubChem CID 15160604) has the molecular formula C15H32N3P and a molecular weight of 285.42 g/mol. Its IUPAC name is 3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile.

Molecular Properties

Compound Name3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile
PubChem CID15160604
Molecular FormulaC15H32N3P
Molecular Weight285.42 g/mol
Exact Mass285.23
IUPAC Name3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile
SMILESCC(C)N(C(C)C)P(CCC#N)N(C(C)C)C(C)C
InChIInChI=1S/C15H32N3P/c1-12(2)17(13(3)4)19(11-9-10-16)18(14(5)6)15(7)8/h12-15H,9,11H2,1-8H3
InChIKeyFZQDHMFHGFAKMY-UHFFFAOYSA-N
XLogP4.45
TPSA30.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.42
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-cyanoethyl N,N-diisopropylphosphonamidic chloride
CID 2735848
chloro-2-cyanoethyl-(N,N-dii-propylamino) phosphine
CID 10977000
N-[butyl-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine
CID 14249294
Bis(di(propan-2-yl)amino)phosphanylformonitrile
CID 13486047
3-[Bis(diethylamino)phosphinothioyl]propanenitrile
CID 23418717
3-Bis[di(propan-2-yl)amino]phosphorylpropanenitrile
CID 2735855
2-cyanoethyl-N,N-di(propan-2-yl)phosphonamidous acid
CID 11138145
[2-Cyanoethyl-[di(propan-2-yl)amino]phosphanyl] hypochlorite
CID 18352444
2-Bis[di(propan-2-yl)amino]phosphanylpropanenitrile
CID 21260953
3-[Di(propan-2-yl)amino]phosphanylpropanenitrile
CID 21713057
2-[Chloro-[di(propan-2-yl)amino]phosphanyl]propanenitrile
CID 22172807
3-[2-Cyanoethyl-[di(propan-2-yl)amino]phosphanyl]propanenitrile
CID 54043326

Frequently Asked Questions

What is the IUPAC name of 3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile?
The IUPAC name of 3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile (CID 15160604) is 3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile.
What is the SMILES notation for 3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile?
The canonical SMILES for 3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile is CC(C)N(C(C)C)P(CCC#N)N(C(C)C)C(C)C.
What is the InChIKey of 3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile?
The InChIKey is FZQDHMFHGFAKMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N3P/c1-12(2)17(13(3)4)19(11-9-10-16)18(14(5)6)15(7)8/h12-15H,9,11H2,1-8H3.
What are the key properties of 3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile?
3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile has a molecular weight of 285.42 g/mol, XLogP of 4.45, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bis[di(propan-2-yl)amino]phosphanylpropanenitrile is sourced from PubChem (CID 15160604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).