1-Benzyloxymethyl-2,2-diphenyl-ethylamine

C22H23NO — CID 44299298

IUPAC1,1-diphenyl-3-phenylmethoxypropan-2-amine
SMILESC1=CC=C(C=C1)COCC(C(C2=CC=CC=C2)C3=CC=CC=C3)N
InChIInChI=1S/C22H23NO/c23-21(17-24-16-18-10-4-1-5-11-18)22(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21-22H,16-17,23H2
InChIKeyQIPWNEBFOZSRLS-UHFFFAOYSA-N
MW317.40 g/mol
LogP4.10
Rot. Bonds7

About 1-Benzyloxymethyl-2,2-diphenyl-ethylamine

1-Benzyloxymethyl-2,2-diphenyl-ethylamine (PubChem CID 44299298) has the molecular formula C22H23NO and a molecular weight of 317.40 g/mol. Its IUPAC name is 1,1-diphenyl-3-phenylmethoxypropan-2-amine.

Molecular Properties

Compound Name1-Benzyloxymethyl-2,2-diphenyl-ethylamine
PubChem CID44299298
Molecular FormulaC22H23NO
Molecular Weight317.40 g/mol
Exact Mass317.18
IUPAC Name1,1-diphenyl-3-phenylmethoxypropan-2-amine
SMILESC1=CC=C(C=C1)COCC(C(C2=CC=CC=C2)C3=CC=CC=C3)N
InChIInChI=1S/C22H23NO/c23-21(17-24-16-18-10-4-1-5-11-18)22(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21-22H,16-17,23H2
InChIKeyQIPWNEBFOZSRLS-UHFFFAOYSA-N
XLogP4.10
TPSA35.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity309

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.40
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Diphenylmethoxy)ethylamine
CID 36060
1-(3,5-Dimethyl-benzyloxymethyl)-2,2-diphenyl-ethylamine
CID 19049319
1-(3,5-Bis-trifluoromethyl-benzyloxymethyl)-2,2-diphenyl-ethylamine
CID 19049350
2-(3,5-Bis-trifluoromethyl-benzyloxy)-1-phenyl-ethylamine
CID 19968650
(S)-2-(3,5-Bis-trifluoromethyl-benzyloxy)-1-phenyl-ethylamine
CID 22859115
(S)-1,1-Diphenyl-3-[[3,5-bis(trifluoromethyl)benzyl]oxy]propane-2-amine
CID 44346694
(S)-(-)-2-Amino-1,1,3-triphenyl-1-propanol
CID 7023048
Fenisorex
CID 10377759
[(S)-1-(3,5-Dimethyl-benzyloxymethyl)-2,2-diphenyl-ethyl]-dimethyl-amine
CID 9976640
N-(2-Benzhydryloxy-ethyl)-N''-(3-phenyl-propyl)-butane-1,4-diamine
CID 10502049
(2S)-1,1-diphenyl-3-phenylmethoxypropan-2-amine
CID 44346480
(2S)-3-[(3-chlorophenyl)methoxy]-1,1-diphenylpropan-2-amine
CID 44346497

Frequently Asked Questions

What is the IUPAC name of 1-Benzyloxymethyl-2,2-diphenyl-ethylamine?
The IUPAC name of 1-Benzyloxymethyl-2,2-diphenyl-ethylamine (CID 44299298) is 1,1-diphenyl-3-phenylmethoxypropan-2-amine.
What is the SMILES notation for 1-Benzyloxymethyl-2,2-diphenyl-ethylamine?
The canonical SMILES for 1-Benzyloxymethyl-2,2-diphenyl-ethylamine is C1=CC=C(C=C1)COCC(C(C2=CC=CC=C2)C3=CC=CC=C3)N.
What is the InChIKey of 1-Benzyloxymethyl-2,2-diphenyl-ethylamine?
The InChIKey is QIPWNEBFOZSRLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO/c23-21(17-24-16-18-10-4-1-5-11-18)22(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21-22H,16-17,23H2.
What are the key properties of 1-Benzyloxymethyl-2,2-diphenyl-ethylamine?
1-Benzyloxymethyl-2,2-diphenyl-ethylamine has a molecular weight of 317.40 g/mol, XLogP of 4.10, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-Benzyloxymethyl-2,2-diphenyl-ethylamine is sourced from PubChem (CID 44299298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).