N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide

C26H30N2O3 — CID 56988348

IUPACN-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide
SMILESCCN(CC)CCOc1cc(NC(=O)c2ccc(-c3ccccc3)cc2)ccc1OC
InChIInChI=1S/C26H30N2O3/c1-4-28(5-2)17-18-31-25-19-23(15-16-24(25)30-3)27-26(29)22-13-11-21(12-14-22)20-9-7-6-8-10-20/h6-16,19H,4-5,17-18H2,1-3H3,(H,27,29)
InChIKeyRPOBCLJBHVBNIA-UHFFFAOYSA-N
MW418.54 g/mol
LogP5.34
Rot. Bonds10

About N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide

N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide (PubChem CID 56988348) has the molecular formula C26H30N2O3 and a molecular weight of 418.54 g/mol. Its IUPAC name is N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide
PubChem CID56988348
Molecular FormulaC26H30N2O3
Molecular Weight418.54 g/mol
Exact Mass418.23
IUPAC NameN-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide
SMILESCCN(CC)CCOc1cc(NC(=O)c2ccc(-c3ccccc3)cc2)ccc1OC
InChIInChI=1S/C26H30N2O3/c1-4-28(5-2)17-18-31-25-19-23(15-16-24(25)30-3)27-26(29)22-13-11-21(12-14-22)20-9-7-6-8-10-20/h6-16,19H,4-5,17-18H2,1-3H3,(H,27,29)
InChIKeyRPOBCLJBHVBNIA-UHFFFAOYSA-N
XLogP5.34
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.54
LogP ≤ 55.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-4-(3-hydroxyphenyl)benzamide
CID 18672596
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]thiophene-2-carboxamide
CID 22459278
N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-4-(3-methoxyphenyl)benzamide
CID 18672554
N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-(3-nitrophenyl)benzamide
CID 18672595
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide
CID 119865025
N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-6-phenylpyridine-3-carboxamide
CID 22459286
N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-2-(4-phenylphenyl)acetamide
CID 139912017
N-(3,4-dimethoxyphenyl)-4-(2-phenoxyethoxy)benzamide
CID 54781369
4-ethoxy-3-methoxy-N-(4-phenylphenyl)benzamide
CID 8880847
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(2-fluorophenyl)sulfanylacetamide
CID 47089567
N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]-4-phenylbenzamide
CID 17229715
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-1-(2-fluorophenyl)pyrazole-3-carboxamide
CID 60610195

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide?
The IUPAC name of N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide (CID 56988348) is N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide.
What is the SMILES notation for N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide?
The canonical SMILES for N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide is CCN(CC)CCOc1cc(NC(=O)c2ccc(-c3ccccc3)cc2)ccc1OC.
What is the InChIKey of N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide?
The InChIKey is RPOBCLJBHVBNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N2O3/c1-4-28(5-2)17-18-31-25-19-23(15-16-24(25)30-3)27-26(29)22-13-11-21(12-14-22)20-9-7-6-8-10-20/h6-16,19H,4-5,17-18H2,1-3H3,(H,27,29).
What are the key properties of N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide?
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide has a molecular weight of 418.54 g/mol, XLogP of 5.34, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide is sourced from PubChem (CID 56988348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).