N-diphenylphosphanylpropan-2-amine

C15H18NP — CID 12809835

IUPACN-diphenylphosphanylpropan-2-amine
SMILESCC(C)NP(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H18NP/c1-13(2)16-17(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16H,1-2H3
InChIKeyPSTAQOIBYVMWTI-UHFFFAOYSA-N
MW243.29 g/mol
LogP3.03
Rot. Bonds4

About N-diphenylphosphanylpropan-2-amine

N-diphenylphosphanylpropan-2-amine (PubChem CID 12809835) has the molecular formula C15H18NP and a molecular weight of 243.29 g/mol. Its IUPAC name is N-diphenylphosphanylpropan-2-amine.

Molecular Properties

Compound NameN-diphenylphosphanylpropan-2-amine
PubChem CID12809835
Molecular FormulaC15H18NP
Molecular Weight243.29 g/mol
Exact Mass243.12
IUPAC NameN-diphenylphosphanylpropan-2-amine
SMILESCC(C)NP(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H18NP/c1-13(2)16-17(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16H,1-2H3
InChIKeyPSTAQOIBYVMWTI-UHFFFAOYSA-N
XLogP3.03
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.29
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-diphenylphosphanylpropan-2-amine?
The IUPAC name of N-diphenylphosphanylpropan-2-amine (CID 12809835) is N-diphenylphosphanylpropan-2-amine.
What is the SMILES notation for N-diphenylphosphanylpropan-2-amine?
The canonical SMILES for N-diphenylphosphanylpropan-2-amine is CC(C)NP(c1ccccc1)c1ccccc1.
What is the InChIKey of N-diphenylphosphanylpropan-2-amine?
The InChIKey is PSTAQOIBYVMWTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18NP/c1-13(2)16-17(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16H,1-2H3.
What are the key properties of N-diphenylphosphanylpropan-2-amine?
N-diphenylphosphanylpropan-2-amine has a molecular weight of 243.29 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-diphenylphosphanylpropan-2-amine is sourced from PubChem (CID 12809835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).