[(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine

C15H18NOP — CID 151443600

IUPAC[(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine
SMILESCOc1ccc(CP(CN)c2ccccc2)cc1
InChIInChI=1S/C15H18NOP/c1-17-14-9-7-13(8-10-14)11-18(12-16)15-5-3-2-4-6-15/h2-10H,11-12,16H2,1H3
InChIKeyPFAMMSFXIKAQOD-UHFFFAOYSA-N
MW259.29 g/mol
LogP2.92
Rot. Bonds5

About [(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine

[(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine (PubChem CID 151443600) has the molecular formula C15H18NOP and a molecular weight of 259.29 g/mol. Its IUPAC name is [(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine.

Molecular Properties

Compound Name[(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine
PubChem CID151443600
Molecular FormulaC15H18NOP
Molecular Weight259.29 g/mol
Exact Mass259.11
IUPAC Name[(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine
SMILESCOc1ccc(CP(CN)c2ccccc2)cc1
InChIInChI=1S/C15H18NOP/c1-17-14-9-7-13(8-10-14)11-18(12-16)15-5-3-2-4-6-15/h2-10H,11-12,16H2,1H3
InChIKeyPFAMMSFXIKAQOD-UHFFFAOYSA-N
XLogP2.92
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.29
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

benzyl-bis(4-methoxyphenyl)phosphane
CID 19835460
(4-methoxyphenyl)methyl-(2-methylphenyl)-phenylphosphane
CID 174887519
bromomethylbenzene;1-(bromomethyl)-4-methoxybenzene
CID 70390972
1-benzyl-4-methoxybenzene;molecular nitrogen
CID 175140604
1-methoxy-4-(4-phenylbutyl)benzene
CID 15647797
benzyl-[(4-methoxyphenyl)methyl]-methylidene-λ4-sulfane
CID 100953226
[4-[[benzyl-[(4-methoxyphenyl)methyl]amino]methyl]phenyl]methanamine
CID 142934531
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
1-methoxy-4-(6-phenylhexyl)benzene
CID 54077830
3-(4-methoxyphenyl)-2-N,2-dimethyl-2-N-phenylpropane-1,2-diamine
CID 60709902
iodo-[(4-methoxyphenyl)methyl]-triphenyl-λ5-phosphane
CID 140526465
1-methoxy-4-[[(R)-phenylsulfinyl]methyl]benzene
CID 40517522

Frequently Asked Questions

What is the IUPAC name of [(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine?
The IUPAC name of [(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine (CID 151443600) is [(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine.
What is the SMILES notation for [(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine?
The canonical SMILES for [(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine is COc1ccc(CP(CN)c2ccccc2)cc1.
What is the InChIKey of [(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine?
The InChIKey is PFAMMSFXIKAQOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18NOP/c1-17-14-9-7-13(8-10-14)11-18(12-16)15-5-3-2-4-6-15/h2-10H,11-12,16H2,1H3.
What are the key properties of [(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine?
[(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine has a molecular weight of 259.29 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-methoxyphenyl)methyl-phenylphosphanyl]methanamine is sourced from PubChem (CID 151443600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).