[[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane

C27H39N2O2PSi2 — CID 10255788

IUPAC[[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane
SMILESC[C@H]1[C@@H](c2ccccc2)O[P@@](=N[Si](C)(C)C)([C@H](O[Si](C)(C)C)c2ccc3ccccc3c2)N1C
InChIInChI=1S/C27H39N2O2PSi2/c1-21-26(23-15-10-9-11-16-23)30-32(29(21)2,28-33(3,4)5)27(31-34(6,7)8)25-19-18-22-14-12-13-17-24(22)20-25/h9-21,26-27H,1-8H3/t21-,26-,27-,32+/m0/s1
InChIKeyGXBGLRFFZBWUNF-OYJHBXMHSA-N
MW510.77 g/mol
LogP8.65
Rot. Bonds6

About [[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane

[[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane (PubChem CID 10255788) has the molecular formula C27H39N2O2PSi2 and a molecular weight of 510.77 g/mol. Its IUPAC name is [[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane.

Molecular Properties

Compound Name[[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane
PubChem CID10255788
Molecular FormulaC27H39N2O2PSi2
Molecular Weight510.77 g/mol
Exact Mass510.23
IUPAC Name[[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane
SMILESC[C@H]1[C@@H](c2ccccc2)O[P@@](=N[Si](C)(C)C)([C@H](O[Si](C)(C)C)c2ccc3ccccc3c2)N1C
InChIInChI=1S/C27H39N2O2PSi2/c1-21-26(23-15-10-9-11-16-23)30-32(29(21)2,28-33(3,4)5)27(31-34(6,7)8)25-19-18-22-14-12-13-17-24(22)20-25/h9-21,26-27H,1-8H3/t21-,26-,27-,32+/m0/s1
InChIKeyGXBGLRFFZBWUNF-OYJHBXMHSA-N
XLogP8.65
TPSA34.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500510.77
LogP ≤ 58.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[[(2S,4S,5R)-3,4-dimethyl-2-[(R)-(4-methylphenyl)-trimethylsilyloxymethyl]-5-phenyl-1,3,2λ5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane
CID 10367657
[(1R)-1-[(4S,5R)-3,4-dimethyl-5-phenyl-2-trimethylsilylimino-1,3,2λ5-oxazaphospholidin-2-yl]pentoxy]-trimethylsilane
CID 23004384
(1,2-dinaphthalen-2-yl-2-trimethylsilyloxyethoxy)-trimethylsilane
CID 10575884
N,N'-bis[(2R,4S,5R)-3,4-dimethyl-2-oxo-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-yl]ethane-1,2-diamine
CID 10743266
(2S,4S,5R)-3,4-dimethyl-N,5-diphenyl-2-sulfanylidene-1,3,2λ5-oxazaphospholidin-2-amine
CID 23416279
1-chloro-N-methyl-1-naphthalen-2-ylmethanamine
CID 116962174
ethane;2-propan-2-ylnaphthalene
CID 142226111
(2S,3R)-2-methyl-3-naphthalen-2-yloxirane
CID 11321352
(5S,6R)-3-[(2S,3S)-3-hydroxy-2-methyl-3-naphthalen-2-ylpropanoyl]-5-methyl-6-phenyl-4-propan-2-yl-1,3,4-oxadiazinan-2-one
CID 101337227
2-(2-methoxy-1-naphthalen-2-ylethyl)naphthalene
CID 3646227
triethoxy(1-naphthalen-2-ylethyl)silane
CID 18795115
(6S,7R)-4-methyl-6-naphthalen-2-yl-7-phenyl-1,4-oxazepane
CID 118675533

Frequently Asked Questions

What is the IUPAC name of [[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane?
The IUPAC name of [[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane (CID 10255788) is [[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane.
What is the SMILES notation for [[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane?
The canonical SMILES for [[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane is C[C@H]1[C@@H](c2ccccc2)O[P@@](=N[Si](C)(C)C)([C@H](O[Si](C)(C)C)c2ccc3ccccc3c2)N1C.
What is the InChIKey of [[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane?
The InChIKey is GXBGLRFFZBWUNF-OYJHBXMHSA-N. The full InChI is InChI=1S/C27H39N2O2PSi2/c1-21-26(23-15-10-9-11-16-23)30-32(29(21)2,28-33(3,4)5)27(31-34(6,7)8)25-19-18-22-14-12-13-17-24(22)20-25/h9-21,26-27H,1-8H3/t21-,26-,27-,32+/m0/s1.
What are the key properties of [[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane?
[[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane has a molecular weight of 510.77 g/mol, XLogP of 8.65, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [[(2S,4S,5R)-3,4-dimethyl-2-[(S)-naphthalen-2-yl(trimethylsilyloxy)methyl]-5-phenyl-1,3,2lambda5-oxazaphospholidin-2-ylidene]amino]-trimethylsilane is sourced from PubChem (CID 10255788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).