diphenylmethanamine;3-hydroxybenzoic acid

C20H19NO3 — CID 3075100

IUPACdiphenylmethanamine;3-hydroxybenzoic acid
SMILESNC(c1ccccc1)c1ccccc1.O=C(O)c1cccc(O)c1
InChIInChI=1S/C13H13N.C7H6O3/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;8-6-3-1-2-5(4-6)7(9)10/h1-10,13H,14H2;1-4,8H,(H,9,10)
InChIKeyRXYVTOLHGUBUPX-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.83
Rot. Bonds3

About diphenylmethanamine;3-hydroxybenzoic acid

diphenylmethanamine;3-hydroxybenzoic acid (PubChem CID 3075100) has the molecular formula C20H19NO3 and a molecular weight of 321.38 g/mol. Its IUPAC name is diphenylmethanamine;3-hydroxybenzoic acid.

Molecular Properties

Compound Namediphenylmethanamine;3-hydroxybenzoic acid
PubChem CID3075100
Molecular FormulaC20H19NO3
Molecular Weight321.38 g/mol
Exact Mass321.14
IUPAC Namediphenylmethanamine;3-hydroxybenzoic acid
SMILESNC(c1ccccc1)c1ccccc1.O=C(O)c1cccc(O)c1
InChIInChI=1S/C13H13N.C7H6O3/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;8-6-3-1-2-5(4-6)7(9)10/h1-10,13H,14H2;1-4,8H,(H,9,10)
InChIKeyRXYVTOLHGUBUPX-UHFFFAOYSA-N
XLogP3.83
TPSA83.55 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

benzoic acid;diphenylmethanamine
CID 3075109
CID 174830791
CID 174830791
CID 66671873
CID 66671873
3-hydroxybenzoic acid;hydrochloride
CID 118389750
benzene-1,3-diol;benzoic acid
CID 53446063
3-[amino-(3-fluorophenyl)methyl]benzoic acid
CID 116938725
3-[amino-(3,4-difluorophenyl)methyl]benzoic acid
CID 116938711
3-[amino(1H-pyrrol-3-yl)methyl]benzoic acid
CID 116938715
3-[(1S)-1-amino-2-hydroxyethyl]benzoic acid
CID 55278123
1,2-bis(3-hydroxyphenyl)ethane-1,2-dione
CID 13158606
benzene-1,3-diol;3-methylbenzoic acid
CID 174723405
3-amino-3-(3-hydroxyphenyl)-2,2-dimethylpropanoic acid
CID 84676780

Frequently Asked Questions

What is the IUPAC name of diphenylmethanamine;3-hydroxybenzoic acid?
The IUPAC name of diphenylmethanamine;3-hydroxybenzoic acid (CID 3075100) is diphenylmethanamine;3-hydroxybenzoic acid.
What is the SMILES notation for diphenylmethanamine;3-hydroxybenzoic acid?
The canonical SMILES for diphenylmethanamine;3-hydroxybenzoic acid is NC(c1ccccc1)c1ccccc1.O=C(O)c1cccc(O)c1.
What is the InChIKey of diphenylmethanamine;3-hydroxybenzoic acid?
The InChIKey is RXYVTOLHGUBUPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N.C7H6O3/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;8-6-3-1-2-5(4-6)7(9)10/h1-10,13H,14H2;1-4,8H,(H,9,10).
What are the key properties of diphenylmethanamine;3-hydroxybenzoic acid?
diphenylmethanamine;3-hydroxybenzoic acid has a molecular weight of 321.38 g/mol, XLogP of 3.83, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylmethanamine;3-hydroxybenzoic acid is sourced from PubChem (CID 3075100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).