N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine

C17H19NO2 — CID 57318921

IUPACN-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine
SMILESCONC(=C(C)OCc1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO2/c1-14(20-13-15-9-5-3-6-10-15)17(18-19-2)16-11-7-4-8-12-16/h3-12,18H,13H2,1-2H3
InChIKeyXUBTUOGKKTXNKL-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.74
Rot. Bonds6

About N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine

N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine (PubChem CID 57318921) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine.

Molecular Properties

Compound NameN-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine
PubChem CID57318921
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine
SMILESCONC(=C(C)OCc1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO2/c1-14(20-13-15-9-5-3-6-10-15)17(18-19-2)16-11-7-4-8-12-16/h3-12,18H,13H2,1-2H3
InChIKeyXUBTUOGKKTXNKL-UHFFFAOYSA-N
XLogP3.74
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

beta-Methoxy-alpha-nitrostilbene
CID 14946043
1-[3-fluoro-4-(methoxymethyl)phenyl]-N-phenylmethoxybut-1-en-1-amine
CID 90825807
1-cyclobutylidene-1-(4-fluorophenyl)-N-phenylmethoxymethanamine
CID 90896555
1-(3-fluoro-4-methylphenyl)-N-phenylmethoxypent-1-en-1-amine
CID 90926595
1-(4-fluorophenyl)-N-phenylmethoxybut-1-en-1-amine
CID 90954616
1-(4-fluorophenyl)-N-phenylmethoxypent-1-en-1-amine
CID 91145559
1-(3-fluoro-4-methylphenyl)-N-phenylmethoxybut-1-en-1-amine
CID 91484777
1-(3-fluoro-4-methylphenyl)-2-methoxy-N-phenylmethoxyethenamine
CID 91608988
N-[1-(4-fluorophenyl)propoxy]-4-prop-2-enoxycyclohexa-1,3-dien-1-amine
CID 131982776
N-(1-phenyl-2-phenylmethoxyethyl)hydroxylamine
CID 14642394
(Z)-1,2-diphenyl-N-(1-phenylbutoxy)ethenamine
CID 134883620
1-phenyl-N-(1-phenylbutoxy)ethenamine
CID 134883649

Frequently Asked Questions

What is the IUPAC name of N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine?
The IUPAC name of N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine (CID 57318921) is N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine.
What is the SMILES notation for N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine?
The canonical SMILES for N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine is CONC(=C(C)OCc1ccccc1)c1ccccc1.
What is the InChIKey of N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine?
The InChIKey is XUBTUOGKKTXNKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-14(20-13-15-9-5-3-6-10-15)17(18-19-2)16-11-7-4-8-12-16/h3-12,18H,13H2,1-2H3.
What are the key properties of N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine?
N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine has a molecular weight of 269.34 g/mol, XLogP of 3.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-1-phenyl-2-phenylmethoxyprop-1-en-1-amine is sourced from PubChem (CID 57318921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).