(S)-amino-(2-diphenylphosphanylphenyl)methanol

C19H18NOP — CID 98228975

IUPAC(S)-amino-(2-diphenylphosphanylphenyl)methanol
SMILESN[C@@H](O)c1ccccc1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H18NOP/c20-19(21)17-13-7-8-14-18(17)22(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,19,21H,20H2/t19-/m0/s1
InChIKeyPUGKRXRRXYUOPD-IBGZPJMESA-N
MW307.33 g/mol
LogP2.39
Rot. Bonds4

About (S)-amino-(2-diphenylphosphanylphenyl)methanol

(S)-amino-(2-diphenylphosphanylphenyl)methanol (PubChem CID 98228975) has the molecular formula C19H18NOP and a molecular weight of 307.33 g/mol. Its IUPAC name is (S)-amino-(2-diphenylphosphanylphenyl)methanol.

Molecular Properties

Compound Name(S)-amino-(2-diphenylphosphanylphenyl)methanol
PubChem CID98228975
Molecular FormulaC19H18NOP
Molecular Weight307.33 g/mol
Exact Mass307.11
IUPAC Name(S)-amino-(2-diphenylphosphanylphenyl)methanol
SMILESN[C@@H](O)c1ccccc1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H18NOP/c20-19(21)17-13-7-8-14-18(17)22(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,19,21H,20H2/t19-/m0/s1
InChIKeyPUGKRXRRXYUOPD-IBGZPJMESA-N
XLogP2.39
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.33
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (S)-amino-(2-diphenylphosphanylphenyl)methanol?
The IUPAC name of (S)-amino-(2-diphenylphosphanylphenyl)methanol (CID 98228975) is (S)-amino-(2-diphenylphosphanylphenyl)methanol.
What is the SMILES notation for (S)-amino-(2-diphenylphosphanylphenyl)methanol?
The canonical SMILES for (S)-amino-(2-diphenylphosphanylphenyl)methanol is N[C@@H](O)c1ccccc1P(c1ccccc1)c1ccccc1.
What is the InChIKey of (S)-amino-(2-diphenylphosphanylphenyl)methanol?
The InChIKey is PUGKRXRRXYUOPD-IBGZPJMESA-N. The full InChI is InChI=1S/C19H18NOP/c20-19(21)17-13-7-8-14-18(17)22(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,19,21H,20H2/t19-/m0/s1.
What are the key properties of (S)-amino-(2-diphenylphosphanylphenyl)methanol?
(S)-amino-(2-diphenylphosphanylphenyl)methanol has a molecular weight of 307.33 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-amino-(2-diphenylphosphanylphenyl)methanol is sourced from PubChem (CID 98228975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).