N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide

C20H18N2O3 — CID 59736690

IUPACN-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(-c3cccc(O)c3)ccc2N)cc1
InChIInChI=1S/C20H18N2O3/c1-25-17-8-5-13(6-9-17)20(24)22-19-12-15(7-10-18(19)21)14-3-2-4-16(23)11-14/h2-12,23H,21H2,1H3,(H,22,24)
InChIKeyVOPLBKUSQCHUEI-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.90
Rot. Bonds4

About N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide

N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide (PubChem CID 59736690) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide
PubChem CID59736690
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC NameN-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(-c3cccc(O)c3)ccc2N)cc1
InChIInChI=1S/C20H18N2O3/c1-25-17-8-5-13(6-9-17)20(24)22-19-12-15(7-10-18(19)21)14-3-2-4-16(23)11-14/h2-12,23H,21H2,1H3,(H,22,24)
InChIKeyVOPLBKUSQCHUEI-UHFFFAOYSA-N
XLogP3.90
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-[2-amino-5-(4-hydroxyphenyl)phenyl]-4-methoxybenzamide
CID 59736664
N-(2-amino-5-phenylphenyl)-4-methoxybenzamide;N-methylmethanamine
CID 66894745
N-(2,4-dihydroxyphenyl)-4-methoxybenzamide
CID 141075428
(4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate
CID 68785591
[4-[4-amino-3-[(4-methoxybenzoyl)amino]phenyl]-1,3-thiazol-2-yl]carbamic acid
CID 87194810
N-(2-amino-5-phenylphenyl)-4-propan-2-ylbenzamide
CID 126707746
N-(2-amino-5-methoxyphenyl)-3-fluorobenzamide
CID 63258141
[4-[(2-amino-5-thiophen-3-ylphenyl)carbamoyl]phenyl] acetate
CID 69101275
methyl N-[[4-[(2-amino-5-phenylphenyl)carbamoyl]phenyl]methyl]carbamate
CID 25032862
N-(2-amino-5-methoxyphenyl)-2-(3-hydroxyphenyl)acetamide
CID 63257743
3-amino-4-[(4-methoxybenzoyl)amino]benzoic acid
CID 63117294
[4-[(2-amino-5-phenylphenyl)carbamoyl]phenyl]phosphonic acid
CID 69002653

Frequently Asked Questions

What is the IUPAC name of N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide?
The IUPAC name of N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide (CID 59736690) is N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide.
What is the SMILES notation for N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide?
The canonical SMILES for N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide is COc1ccc(C(=O)Nc2cc(-c3cccc(O)c3)ccc2N)cc1.
What is the InChIKey of N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide?
The InChIKey is VOPLBKUSQCHUEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3/c1-25-17-8-5-13(6-9-17)20(24)22-19-12-15(7-10-18(19)21)14-3-2-4-16(23)11-14/h2-12,23H,21H2,1H3,(H,22,24).
What are the key properties of N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide?
N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide has a molecular weight of 334.38 g/mol, XLogP of 3.90, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide is sourced from PubChem (CID 59736690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).