dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol

C19H28NO2P — CID 118588489

IUPACdimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol
SMILESCP(C)c1ccccc1.Cc1cccc(N(CCO)CCO)c1
InChIInChI=1S/C11H17NO2.C8H11P/c1-10-3-2-4-11(9-10)12(5-7-13)6-8-14;1-9(2)8-6-4-3-5-7-8/h2-4,9,13-14H,5-8H2,1H3;3-7H,1-2H3
InChIKeyCHUFRJNYXYLKKP-UHFFFAOYSA-N
MW333.41 g/mol
LogP2.84
Rot. Bonds6

About dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol

dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol (PubChem CID 118588489) has the molecular formula C19H28NO2P and a molecular weight of 333.41 g/mol. Its IUPAC name is dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol.

Molecular Properties

Compound Namedimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol
PubChem CID118588489
Molecular FormulaC19H28NO2P
Molecular Weight333.41 g/mol
Exact Mass333.19
IUPAC Namedimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol
SMILESCP(C)c1ccccc1.Cc1cccc(N(CCO)CCO)c1
InChIInChI=1S/C11H17NO2.C8H11P/c1-10-3-2-4-11(9-10)12(5-7-13)6-8-14;1-9(2)8-6-4-3-5-7-8/h2-4,9,13-14H,5-8H2,1H3;3-7H,1-2H3
InChIKeyCHUFRJNYXYLKKP-UHFFFAOYSA-N
XLogP2.84
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol
CID 143917087
2-(N-ethylanilino)ethanol;2-(N-ethyl-3-methylanilino)ethanol
CID 67646691
2-[N-[2-(2-hydroxyethoxy)ethyl]-3-methylanilino]ethanol
CID 54440196
ethane;2-(N-ethyl-3-methylanilino)ethanol
CID 142945476
2-[3-methyl-N-(2-methylpropyl)anilino]ethanol
CID 91509745
2-[N-(2-hydroxyethyl)anilino]ethanol;hydrobromide
CID 21388011
N-(2-hydroxyethyl)-N-(3-methylphenyl)benzamide
CID 91297666
CID 138691667
CID 138691667
N-(2-hydroxyethyl)-N-(3-methylphenyl)nitramide
CID 70276550
N,N-dibutyl-3-methylaniline
CID 15332677
acetic acid;2-[N-(2-hydroxyethyl)anilino]ethanol
CID 22412424
3-(3-methyl-N-propylanilino)propanoic acid
CID 82317776

Frequently Asked Questions

What is the IUPAC name of dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol?
The IUPAC name of dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol (CID 118588489) is dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol.
What is the SMILES notation for dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol?
The canonical SMILES for dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol is CP(C)c1ccccc1.Cc1cccc(N(CCO)CCO)c1.
What is the InChIKey of dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol?
The InChIKey is CHUFRJNYXYLKKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2.C8H11P/c1-10-3-2-4-11(9-10)12(5-7-13)6-8-14;1-9(2)8-6-4-3-5-7-8/h2-4,9,13-14H,5-8H2,1H3;3-7H,1-2H3.
What are the key properties of dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol?
dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol has a molecular weight of 333.41 g/mol, XLogP of 2.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl(phenyl)phosphane;2-[N-(2-hydroxyethyl)-3-methylanilino]ethanol is sourced from PubChem (CID 118588489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).