2-methoxy-1,2-diphenylethanamine

C15H17NO — CID 12843502

IUPAC2-methoxy-1,2-diphenylethanamine
SMILESCOC(c1ccccc1)C(N)c1ccccc1
InChIInChI=1S/C15H17NO/c1-17-15(13-10-6-3-7-11-13)14(16)12-8-4-2-5-9-12/h2-11,14-15H,16H2,1H3
InChIKeyPCGSVMMXAQSTKX-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.07
Rot. Bonds4

About 2-methoxy-1,2-diphenylethanamine

2-methoxy-1,2-diphenylethanamine (PubChem CID 12843502) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-methoxy-1,2-diphenylethanamine.

Molecular Properties

Compound Name2-methoxy-1,2-diphenylethanamine
PubChem CID12843502
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name2-methoxy-1,2-diphenylethanamine
SMILESCOC(c1ccccc1)C(N)c1ccccc1
InChIInChI=1S/C15H17NO/c1-17-15(13-10-6-3-7-11-13)14(16)12-8-4-2-5-9-12/h2-11,14-15H,16H2,1H3
InChIKeyPCGSVMMXAQSTKX-UHFFFAOYSA-N
XLogP3.07
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Phenmetrazine
CID 4762
Phenmetrazine Hydrochloride
CID 92159
(1S,2R)-(+)-2-Amino-1,2-diphenylethanol
CID 719822
2-(Diphenylmethoxy)ethylamine
CID 36060
2-Amino-1,2-diphenylethanol
CID 22243
1-(Benzyloxy)propan-2-amine
CID 296020
(1R,2S)-(-)-2-Amino-1,2-diphenylethanol
CID 719819
N-Desmethyldiphenhydramine
CID 40791
3-Benzyloxy-2-phenyl-piperidine
CID 44331794
1-(3,5-Dimethyl-benzyloxymethyl)-2,2-diphenyl-ethylamine
CID 19049319
2-(3,5-Bis-trifluoromethyl-benzyloxy)-1-phenyl-ethylamine
CID 19968650
(S)-2-(3,5-Bis-trifluoromethyl-benzyloxy)-1-phenyl-ethylamine
CID 22859115

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1,2-diphenylethanamine?
The IUPAC name of 2-methoxy-1,2-diphenylethanamine (CID 12843502) is 2-methoxy-1,2-diphenylethanamine.
What is the SMILES notation for 2-methoxy-1,2-diphenylethanamine?
The canonical SMILES for 2-methoxy-1,2-diphenylethanamine is COC(c1ccccc1)C(N)c1ccccc1.
What is the InChIKey of 2-methoxy-1,2-diphenylethanamine?
The InChIKey is PCGSVMMXAQSTKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-17-15(13-10-6-3-7-11-13)14(16)12-8-4-2-5-9-12/h2-11,14-15H,16H2,1H3.
What are the key properties of 2-methoxy-1,2-diphenylethanamine?
2-methoxy-1,2-diphenylethanamine has a molecular weight of 227.31 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1,2-diphenylethanamine is sourced from PubChem (CID 12843502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).