4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide

C20H25NO4 — CID 110422258

IUPAC4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide
SMILESCCOc1ccc(NC(=O)CCCc2ccc(OC)c(OC)c2)cc1
InChIInChI=1S/C20H25NO4/c1-4-25-17-11-9-16(10-12-17)21-20(22)7-5-6-15-8-13-18(23-2)19(14-15)24-3/h8-14H,4-7H2,1-3H3,(H,21,22)
InChIKeyNRGAJNSCMDLJLD-UHFFFAOYSA-N
MW343.42 g/mol
LogP4.06
Rot. Bonds9

About 4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide

4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide (PubChem CID 110422258) has the molecular formula C20H25NO4 and a molecular weight of 343.42 g/mol. Its IUPAC name is 4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide.

Molecular Properties

Compound Name4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide
PubChem CID110422258
Molecular FormulaC20H25NO4
Molecular Weight343.42 g/mol
Exact Mass343.18
IUPAC Name4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide
SMILESCCOc1ccc(NC(=O)CCCc2ccc(OC)c(OC)c2)cc1
InChIInChI=1S/C20H25NO4/c1-4-25-17-11-9-16(10-12-17)21-20(22)7-5-6-15-8-13-18(23-2)19(14-15)24-3/h8-14H,4-7H2,1-3H3,(H,21,22)
InChIKeyNRGAJNSCMDLJLD-UHFFFAOYSA-N
XLogP4.06
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.42
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetamidophenyl)-4-(3,4-dimethoxyphenyl)butanamide
CID 110423899
N-(4-butoxyphenyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 19220649
3-(3-amino-4-methoxyphenyl)-N-(4-ethoxyphenyl)propanamide
CID 39456651
4-(3,4-dimethoxyphenyl)-N-[4-(dimethylamino)phenyl]butanamide
CID 110424664
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanylacetamide
CID 40824439
N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-4-(4-ethoxyphenyl)butanamide
CID 6047418
3-(4-ethoxy-3-methoxyphenyl)-N-(4-iodophenyl)propanamide
CID 19221776
N-(3-amino-4-methoxyphenyl)-3-(4-ethoxyphenyl)propanamide
CID 119419441
N,N'-bis(4-ethoxyphenyl)nonanediamide
CID 4507995
N-(4-ethoxyphenyl)-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
CID 26915649
3-(3-amino-4-ethoxyphenyl)-N-(4-ethoxyphenyl)propanamide
CID 82153635
N-[4-(dimethylamino)phenyl]-3-(4-ethoxy-3-methoxyphenyl)propanamide
CID 19221846

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide?
The IUPAC name of 4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide (CID 110422258) is 4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide.
What is the SMILES notation for 4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide?
The canonical SMILES for 4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide is CCOc1ccc(NC(=O)CCCc2ccc(OC)c(OC)c2)cc1.
What is the InChIKey of 4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide?
The InChIKey is NRGAJNSCMDLJLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO4/c1-4-25-17-11-9-16(10-12-17)21-20(22)7-5-6-15-8-13-18(23-2)19(14-15)24-3/h8-14H,4-7H2,1-3H3,(H,21,22).
What are the key properties of 4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide?
4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide has a molecular weight of 343.42 g/mol, XLogP of 4.06, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dimethoxyphenyl)-N-(4-ethoxyphenyl)butanamide is sourced from PubChem (CID 110422258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).