4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide

C23H33N3O2 — CID 18672626

IUPAC4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide
SMILESCC(C)N(CCOc1ccccc1NC(=O)c1ccc(N(C)C)cc1)C(C)C
InChIInChI=1S/C23H33N3O2/c1-17(2)26(18(3)4)15-16-28-22-10-8-7-9-21(22)24-23(27)19-11-13-20(14-12-19)25(5)6/h7-14,17-18H,15-16H2,1-6H3,(H,24,27)
InChIKeyKWYSLYSUDZOPGZ-UHFFFAOYSA-N
MW383.54 g/mol
LogP4.50
Rot. Bonds9

About 4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide

4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide (PubChem CID 18672626) has the molecular formula C23H33N3O2 and a molecular weight of 383.54 g/mol. Its IUPAC name is 4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide
PubChem CID18672626
Molecular FormulaC23H33N3O2
Molecular Weight383.54 g/mol
Exact Mass383.26
IUPAC Name4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide
SMILESCC(C)N(CCOc1ccccc1NC(=O)c1ccc(N(C)C)cc1)C(C)C
InChIInChI=1S/C23H33N3O2/c1-17(2)26(18(3)4)15-16-28-22-10-8-7-9-21(22)24-23(27)19-11-13-20(14-12-19)25(5)6/h7-14,17-18H,15-16H2,1-6H3,(H,24,27)
InChIKeyKWYSLYSUDZOPGZ-UHFFFAOYSA-N
XLogP4.50
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.54
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[2-(dimethylamino)ethoxy]phenyl]-4-phenylbenzamide
CID 18672579
1-N,4-N-bis(2-butoxyphenyl)benzene-1,4-dicarboxamide
CID 17087319
N-[2-[2-(diethylamino)ethoxy]phenyl]-4-(phenoxymethyl)benzamide
CID 55528750
4-(dimethylamino)-N-[2-(hydroxymethyl)phenyl]benzamide
CID 60653502
N-[2-(1-chloroethyl)phenyl]-4-(dimethylamino)benzamide
CID 114304830
N-[4-[2-[di(propan-2-yl)amino]ethoxy]-2-formyl-5-methoxyphenyl]-4-phenylbenzamide
CID 86591615
N-[2-(2-phenoxyethoxy)phenyl]-4-phenylbenzamide
CID 17130808
4-(butan-2-ylsulfamoyl)-N-(2-propoxyphenyl)benzamide
CID 46575308
4-amino-N-[2-(2-methylpropoxy)phenyl]benzamide
CID 60927264
4-[2-[2-[(4-methoxybenzoyl)amino]phenoxy]ethoxy]benzoic acid
CID 68690130
1-N-[4-(dimethylamino)phenyl]-4-N-(2-ethylphenyl)benzene-1,4-dicarboxamide
CID 109049739
4-(bromomethyl)-N-(2-propoxyphenyl)benzamide
CID 102851101

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide?
The IUPAC name of 4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide (CID 18672626) is 4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide?
The canonical SMILES for 4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide is CC(C)N(CCOc1ccccc1NC(=O)c1ccc(N(C)C)cc1)C(C)C.
What is the InChIKey of 4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide?
The InChIKey is KWYSLYSUDZOPGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33N3O2/c1-17(2)26(18(3)4)15-16-28-22-10-8-7-9-21(22)24-23(27)19-11-13-20(14-12-19)25(5)6/h7-14,17-18H,15-16H2,1-6H3,(H,24,27).
What are the key properties of 4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide?
4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide has a molecular weight of 383.54 g/mol, XLogP of 4.50, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]benzamide is sourced from PubChem (CID 18672626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).