(5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone

C15H15NO2 — CID 82084658

IUPAC(5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone
SMILESCOc1ccc(N)cc1C(=O)c1ccccc1C
InChIInChI=1S/C15H15NO2/c1-10-5-3-4-6-12(10)15(17)13-9-11(16)7-8-14(13)18-2/h3-9H,16H2,1-2H3
InChIKeyKASBYWPWIYLDEB-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.82
Rot. Bonds3

About (5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone

(5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone (PubChem CID 82084658) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is (5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone.

Molecular Properties

Compound Name(5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone
PubChem CID82084658
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Name(5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone
SMILESCOc1ccc(N)cc1C(=O)c1ccccc1C
InChIInChI=1S/C15H15NO2/c1-10-5-3-4-6-12(10)15(17)13-9-11(16)7-8-14(13)18-2/h3-9H,16H2,1-2H3
InChIKeyKASBYWPWIYLDEB-UHFFFAOYSA-N
XLogP2.82
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(4-amino-2-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanone
CID 104784994
5-amino-2-methoxy-N-methyl-N-(2-methylphenyl)benzamide
CID 62002550
[2-methoxy-5-[2-[2-[3-(2-methoxybenzoyl)-4-methylphenyl]phenyl]phenyl]phenyl]-(2-methylphenyl)methanone
CID 144622608
ethyl 5-amino-2-methoxybenzoate
CID 22180184
5-amino-N-(2,3-dimethylphenyl)-2-methoxybenzamide
CID 61090377
[2-(2-methylbenzoyl)phenyl]-(2-methylphenyl)methanone
CID 15597717
(3-amino-2-methylphenyl)-(2-methoxy-4,5-dimethylphenyl)methanone
CID 82092906
(3-amino-2-chlorophenyl)-(2-methoxy-5-methylphenyl)methanone
CID 112580781
(5-amino-2,3-dichlorophenyl)-(2-methoxy-5-methylphenyl)methanone
CID 107201476
(2,6-dimethylphenyl)-(2-methoxyphenyl)methanone
CID 24722767
(5-amino-2-pyridinyl)-(2-methylphenyl)methanone
CID 116605299
(3-amino-2-methylphenyl)-(2-methoxyphenyl)methanone
CID 82044477

Frequently Asked Questions

What is the IUPAC name of (5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone?
The IUPAC name of (5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone (CID 82084658) is (5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone.
What is the SMILES notation for (5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone?
The canonical SMILES for (5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone is COc1ccc(N)cc1C(=O)c1ccccc1C.
What is the InChIKey of (5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone?
The InChIKey is KASBYWPWIYLDEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c1-10-5-3-4-6-12(10)15(17)13-9-11(16)7-8-14(13)18-2/h3-9H,16H2,1-2H3.
What are the key properties of (5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone?
(5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone has a molecular weight of 241.29 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone is sourced from PubChem (CID 82084658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).