3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine

C22H24N2O — CID 67801484

IUPAC3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine
SMILESCOc1ccccc1CC(N)C(N)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H24N2O/c1-25-20-15-9-8-10-17(20)16-21(23)22(24,18-11-4-2-5-12-18)19-13-6-3-7-14-19/h2-15,21H,16,23-24H2,1H3
InChIKeyOCRZNUUOJZQFJF-UHFFFAOYSA-N
MW332.45 g/mol
LogP3.47
Rot. Bonds6

About 3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine

3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine (PubChem CID 67801484) has the molecular formula C22H24N2O and a molecular weight of 332.45 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine
PubChem CID67801484
Molecular FormulaC22H24N2O
Molecular Weight332.45 g/mol
Exact Mass332.19
IUPAC Name3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine
SMILESCOc1ccccc1CC(N)C(N)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H24N2O/c1-25-20-15-9-8-10-17(20)16-21(23)22(24,18-11-4-2-5-12-18)19-13-6-3-7-14-19/h2-15,21H,16,23-24H2,1H3
InChIKeyOCRZNUUOJZQFJF-UHFFFAOYSA-N
XLogP3.47
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxyphenyl)propan-2-amine;hydrochloride
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4-(2-methoxyphenyl)butane-1,3-diamine
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CID 10703616
(2R)-1-(2-methoxyphenyl)propan-2-ol
CID 6951555
[(2R)-1-(2-methoxyphenyl)propan-2-yl]azanium
CID 7432380
2-(2-methoxyphenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanamine
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CID 79446963

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine?
The IUPAC name of 3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine (CID 67801484) is 3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine.
What is the SMILES notation for 3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine?
The canonical SMILES for 3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine is COc1ccccc1CC(N)C(N)(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine?
The InChIKey is OCRZNUUOJZQFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O/c1-25-20-15-9-8-10-17(20)16-21(23)22(24,18-11-4-2-5-12-18)19-13-6-3-7-14-19/h2-15,21H,16,23-24H2,1H3.
What are the key properties of 3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine?
3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine has a molecular weight of 332.45 g/mol, XLogP of 3.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-1,1-diphenylpropane-1,2-diamine is sourced from PubChem (CID 67801484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).