diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane

C6H14N4P4 — CID 58622752

IUPACdiphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane
SMILESC[C@H]1Cc2nnnn2C[C@@H]1P(P)PP
InChIInChI=1S/C6H14N4P4/c1-4-2-6-7-8-9-10(6)3-5(4)14(12)13-11/h4-5,13H,2-3,11-12H2,1H3/t4-,5-,14?/m0/s1
InChIKeyPKYCYDOUYOGYPK-ITCNMRAQSA-N
MW266.10 g/mol
LogP1.89
Rot. Bonds2

About diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane

diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane (PubChem CID 58622752) has the molecular formula C6H14N4P4 and a molecular weight of 266.10 g/mol. Its IUPAC name is diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane.

Molecular Properties

Compound Namediphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane
PubChem CID58622752
Molecular FormulaC6H14N4P4
Molecular Weight266.10 g/mol
Exact Mass266.02
IUPAC Namediphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane
SMILESC[C@H]1Cc2nnnn2C[C@@H]1P(P)PP
InChIInChI=1S/C6H14N4P4/c1-4-2-6-7-8-9-10(6)3-5(4)14(12)13-11/h4-5,13H,2-3,11-12H2,1H3/t4-,5-,14?/m0/s1
InChIKeyPKYCYDOUYOGYPK-ITCNMRAQSA-N
XLogP1.89
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.10
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane?
The IUPAC name of diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane (CID 58622752) is diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane.
What is the SMILES notation for diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane?
The canonical SMILES for diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane is C[C@H]1Cc2nnnn2C[C@@H]1P(P)PP.
What is the InChIKey of diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane?
The InChIKey is PKYCYDOUYOGYPK-ITCNMRAQSA-N. The full InChI is InChI=1S/C6H14N4P4/c1-4-2-6-7-8-9-10(6)3-5(4)14(12)13-11/h4-5,13H,2-3,11-12H2,1H3/t4-,5-,14?/m0/s1.
What are the key properties of diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane?
diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane has a molecular weight of 266.10 g/mol, XLogP of 1.89, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diphosphanyl-[(6R,7S)-7-methyl-5,6,7,8-tetrahydrotetrazolo[1,5-a]pyridin-6-yl]-phosphanylphosphane is sourced from PubChem (CID 58622752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).