2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide

C19H22Cl2N2O — CID 7892153

IUPAC2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide
SMILESCCN(c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1)C(C)C
InChIInChI=1S/C19H22Cl2N2O/c1-4-23(13(2)3)16-8-6-15(7-9-16)22-19(24)12-14-5-10-17(20)18(21)11-14/h5-11,13H,4,12H2,1-3H3,(H,22,24)
InChIKeyRPEJZUQVPMFXKV-UHFFFAOYSA-N
MW365.30 g/mol
LogP5.41
Rot. Bonds6

About 2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide

2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide (PubChem CID 7892153) has the molecular formula C19H22Cl2N2O and a molecular weight of 365.30 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide
PubChem CID7892153
Molecular FormulaC19H22Cl2N2O
Molecular Weight365.30 g/mol
Exact Mass364.11
IUPAC Name2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide
SMILESCCN(c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1)C(C)C
InChIInChI=1S/C19H22Cl2N2O/c1-4-23(13(2)3)16-8-6-15(7-9-16)22-19(24)12-14-5-10-17(20)18(21)11-14/h5-11,13H,4,12H2,1-3H3,(H,22,24)
InChIKeyRPEJZUQVPMFXKV-UHFFFAOYSA-N
XLogP5.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.30
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide?
The IUPAC name of 2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide (CID 7892153) is 2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide?
The canonical SMILES for 2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide is CCN(c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1)C(C)C.
What is the InChIKey of 2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide?
The InChIKey is RPEJZUQVPMFXKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22Cl2N2O/c1-4-23(13(2)3)16-8-6-15(7-9-16)22-19(24)12-14-5-10-17(20)18(21)11-14/h5-11,13H,4,12H2,1-3H3,(H,22,24).
What are the key properties of 2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide?
2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide has a molecular weight of 365.30 g/mol, XLogP of 5.41, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide is sourced from PubChem (CID 7892153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).