N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide

C15H16N2O2 — CID 61399690

IUPACN-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide
SMILESCN(C(=O)Cc1cccc(O)c1)c1ccc(N)cc1
InChIInChI=1S/C15H16N2O2/c1-17(13-7-5-12(16)6-8-13)15(19)10-11-3-2-4-14(18)9-11/h2-9,18H,10,16H2,1H3
InChIKeyUXKPLOOQXUEYHR-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.18
Rot. Bonds3

About N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide

N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide (PubChem CID 61399690) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide
PubChem CID61399690
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide
SMILESCN(C(=O)Cc1cccc(O)c1)c1ccc(N)cc1
InChIInChI=1S/C15H16N2O2/c1-17(13-7-5-12(16)6-8-13)15(19)10-11-3-2-4-14(18)9-11/h2-9,18H,10,16H2,1H3
InChIKeyUXKPLOOQXUEYHR-UHFFFAOYSA-N
XLogP2.18
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(3-bromophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
CID 107735949
3-(4-aminophenyl)-N-(3-hydroxyphenyl)-N-methylbutanamide
CID 107734626
N-[4-(aminomethyl)phenyl]-N-methyl-2-phenylacetamide
CID 28755638
2-(4-aminophenyl)-N-methyl-N-(4-propan-2-ylphenyl)acetamide;hydrochloride
CID 119807717
3-(3-aminophenyl)-N-(4-hydroxyphenyl)-N-methylpropanamide
CID 107732992
N-(4-aminophenyl)-2-[(3-chlorophenyl)methoxy]-N-methylacetamide
CID 65125098
2-(3-bromophenyl)-N-methyl-N-phenylacetamide
CID 22341541
N-ethyl-N,2-bis(3-hydroxyphenyl)acetamide
CID 107735678
4-[methyl-[2-(3-methylphenyl)acetyl]amino]benzoic acid
CID 104698086
1-(3-aminophenyl)-3-(3-hydroxyphenyl)propan-2-one
CID 116577080
N-(4-aminophenyl)-N-methyl-2-thiophen-2-ylacetamide
CID 43114422
N-(4-aminobutan-2-yl)-2-(3-hydroxyphenyl)-N-methylacetamide
CID 55173941

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide?
The IUPAC name of N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide (CID 61399690) is N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide.
What is the SMILES notation for N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide?
The canonical SMILES for N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide is CN(C(=O)Cc1cccc(O)c1)c1ccc(N)cc1.
What is the InChIKey of N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide?
The InChIKey is UXKPLOOQXUEYHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-17(13-7-5-12(16)6-8-13)15(19)10-11-3-2-4-14(18)9-11/h2-9,18H,10,16H2,1H3.
What are the key properties of N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide?
N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide has a molecular weight of 256.31 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-2-(3-hydroxyphenyl)-N-methylacetamide is sourced from PubChem (CID 61399690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).