[6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane

C19H35NP2 — CID 15398915

IUPAC[6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane
SMILESCC(C)P(Cc1cccc(CP(C(C)C)C(C)C)n1)C(C)C
InChIInChI=1S/C19H35NP2/c1-14(2)21(15(3)4)12-18-10-9-11-19(20-18)13-22(16(5)6)17(7)8/h9-11,14-17H,12-13H2,1-8H3
InChIKeyISALXWZSPYRWEM-UHFFFAOYSA-N
MW339.44 g/mol
LogP6.68
Rot. Bonds8

About [6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane

[6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane (PubChem CID 15398915) has the molecular formula C19H35NP2 and a molecular weight of 339.44 g/mol. Its IUPAC name is [6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane.

Molecular Properties

Compound Name[6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane
PubChem CID15398915
Molecular FormulaC19H35NP2
Molecular Weight339.44 g/mol
Exact Mass339.22
IUPAC Name[6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane
SMILESCC(C)P(Cc1cccc(CP(C(C)C)C(C)C)n1)C(C)C
InChIInChI=1S/C19H35NP2/c1-14(2)21(15(3)4)12-18-10-9-11-19(20-18)13-22(16(5)6)17(7)8/h9-11,14-17H,12-13H2,1-8H3
InChIKeyISALXWZSPYRWEM-UHFFFAOYSA-N
XLogP6.68
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.44
LogP ≤ 56.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane?
The IUPAC name of [6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane (CID 15398915) is [6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane.
What is the SMILES notation for [6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane?
The canonical SMILES for [6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane is CC(C)P(Cc1cccc(CP(C(C)C)C(C)C)n1)C(C)C.
What is the InChIKey of [6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane?
The InChIKey is ISALXWZSPYRWEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35NP2/c1-14(2)21(15(3)4)12-18-10-9-11-19(20-18)13-22(16(5)6)17(7)8/h9-11,14-17H,12-13H2,1-8H3.
What are the key properties of [6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane?
[6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane has a molecular weight of 339.44 g/mol, XLogP of 6.68, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[di(propan-2-yl)phosphanylmethyl]-2-pyridinyl]methyl-di(propan-2-yl)phosphane is sourced from PubChem (CID 15398915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).