2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine

C8H20N3O2P — CID 170393494

IUPAC2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine
SMILESC=P(N=C(N(C)C)N(C)C)(OC)OC
InChIInChI=1S/C8H20N3O2P/c1-10(2)8(11(3)4)9-14(7,12-5)13-6/h7H2,1-6H3
InChIKeyFBENTBSWIRAKCM-UHFFFAOYSA-N
MW221.24 g/mol
LogP0.95
Rot. Bonds3

About 2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine

2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine (PubChem CID 170393494) has the molecular formula C8H20N3O2P and a molecular weight of 221.24 g/mol. Its IUPAC name is 2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine.

Molecular Properties

Compound Name2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine
PubChem CID170393494
Molecular FormulaC8H20N3O2P
Molecular Weight221.24 g/mol
Exact Mass221.13
IUPAC Name2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine
SMILESC=P(N=C(N(C)C)N(C)C)(OC)OC
InChIInChI=1S/C8H20N3O2P/c1-10(2)8(11(3)4)9-14(7,12-5)13-6/h7H2,1-6H3
InChIKeyFBENTBSWIRAKCM-UHFFFAOYSA-N
XLogP0.95
TPSA37.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.24
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxy-3,3-dimethylbutyl)-1,1,3,3-tetramethylguanidine;hydroiodide
CID 111757968
tetrakis[bis(dimethylamino)methylideneamino]phosphanium chloride
CID 160570249
N,N-dimethylmethanamine;methyl dihydrogen phosphate
CID 161217786
methyl 3-[bis(dimethylamino)methylideneamino]-2-methylpropanoate;hydroiodide
CID 111097464
fluoro-methoxy-methyl-methylidene-λ5-phosphane
CID 58860378
2-[4-(2-methoxyethoxy)butyl]-1,1,3,3-tetramethylguanidine;hydroiodide
CID 111095275
CID 155632794
CID 155632794
N-[methoxy(methyl)phosphinothioyl]-N-methylmethanamine
CID 13426246
[bis(dimethylamino)methylideneamino]-trimethylazanium
CID 145088193
molecular iodine;trimethoxy(methylidene)-λ5-phosphane
CID 161316656
1-chloro-1,2,3,3-tetramethylguanidine
CID 53439431
methyl N-[bis(dimethylamino)methylidenecarbamothioyl]carbamate
CID 135083719

Frequently Asked Questions

What is the IUPAC name of 2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine?
The IUPAC name of 2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine (CID 170393494) is 2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine.
What is the SMILES notation for 2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine?
The canonical SMILES for 2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine is C=P(N=C(N(C)C)N(C)C)(OC)OC.
What is the InChIKey of 2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine?
The InChIKey is FBENTBSWIRAKCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N3O2P/c1-10(2)8(11(3)4)9-14(7,12-5)13-6/h7H2,1-6H3.
What are the key properties of 2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine?
2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine has a molecular weight of 221.24 g/mol, XLogP of 0.95, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[dimethoxy(methylidene)-λ5-phosphanyl]-1,1,3,3-tetramethylguanidine is sourced from PubChem (CID 170393494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).