(2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone

C17H19NO3 — CID 3243415

IUPAC(2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone
SMILESCOc1ccc(C(=O)c2ccc(N(C)C)cc2)c(OC)c1
InChIInChI=1S/C17H19NO3/c1-18(2)13-7-5-12(6-8-13)17(19)15-10-9-14(20-3)11-16(15)21-4/h5-11H,1-4H3
InChIKeySDGFSCCPELJHBP-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.00
Rot. Bonds5

About (2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone

(2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone (PubChem CID 3243415) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is (2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone.

Molecular Properties

Compound Name(2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone
PubChem CID3243415
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name(2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone
SMILESCOc1ccc(C(=O)c2ccc(N(C)C)cc2)c(OC)c1
InChIInChI=1S/C17H19NO3/c1-18(2)13-7-5-12(6-8-13)17(19)15-10-9-14(20-3)11-16(15)21-4/h5-11H,1-4H3
InChIKeySDGFSCCPELJHBP-UHFFFAOYSA-N
XLogP3.00
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2,4-dimethoxyphenyl)-(4-methylsulfanylphenyl)methanone
CID 112694184
(4-bromo-3-methylphenyl)-(2,4-dimethoxyphenyl)methanone
CID 114971196
(3-bromo-4-chlorophenyl)-(2,4-dimethoxyphenyl)methanone
CID 115565794
[2-[4-(dimethylamino)anilino]-2-oxoethyl] 2,4-dimethoxybenzoate
CID 2504998
2,4-dimethoxybenzoic acid
CID 7052
2,4-dimethoxybenzoic acid
CID 67450326
(4-methoxy-2-trimethylsilyloxyphenyl)-(4-methylphenyl)methanone
CID 91741601
[2-(2-acetyloxy-4-methoxybenzoyl)-5-methoxyphenyl] acetate
CID 121279078
2,4-dimethoxybenzoate
CID 6947027
(3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone
CID 114965510
(2-bromo-4-methoxyphenyl)-(4-bromophenyl)methanone
CID 60786107
2-chloro-N-[5-(2,4-dimethoxybenzoyl)-2-methoxyphenyl]acetamide
CID 3058399

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone?
The IUPAC name of (2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone (CID 3243415) is (2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone.
What is the SMILES notation for (2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone?
The canonical SMILES for (2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone is COc1ccc(C(=O)c2ccc(N(C)C)cc2)c(OC)c1.
What is the InChIKey of (2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone?
The InChIKey is SDGFSCCPELJHBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-18(2)13-7-5-12(6-8-13)17(19)15-10-9-14(20-3)11-16(15)21-4/h5-11H,1-4H3.
What are the key properties of (2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone?
(2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone has a molecular weight of 285.34 g/mol, XLogP of 3.00, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanone is sourced from PubChem (CID 3243415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).