2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide

C17H18Cl2N2O — CID 69398154

IUPAC2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide
SMILESCC(CNC(=O)CN)(c1ccccc1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C17H18Cl2N2O/c1-17(11-21-16(22)10-20,12-5-3-2-4-6-12)13-7-8-14(18)15(19)9-13/h2-9H,10-11,20H2,1H3,(H,21,22)
InChIKeySETNTZYHTXZKIH-UHFFFAOYSA-N
MW337.25 g/mol
LogP3.37
Rot. Bonds5

About 2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide

2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide (PubChem CID 69398154) has the molecular formula C17H18Cl2N2O and a molecular weight of 337.25 g/mol. Its IUPAC name is 2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide
PubChem CID69398154
Molecular FormulaC17H18Cl2N2O
Molecular Weight337.25 g/mol
Exact Mass336.08
IUPAC Name2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide
SMILESCC(CNC(=O)CN)(c1ccccc1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C17H18Cl2N2O/c1-17(11-21-16(22)10-20,12-5-3-2-4-6-12)13-7-8-14(18)15(19)9-13/h2-9H,10-11,20H2,1H3,(H,21,22)
InChIKeySETNTZYHTXZKIH-UHFFFAOYSA-N
XLogP3.37
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.25
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2,2-dimethyl-3-phenylpropyl)acetamide
CID 119329644
2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide
CID 119319554
2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride
CID 119319553
3,4-dichloro-N-(2-hydroxy-2-phenylpropyl)benzamide
CID 121111944
(2S)-2-amino-2-(3,4-dichlorophenyl)propanoic acid;hydrochloride
CID 68715954
5-chloro-N-(2,2-diphenylpropyl)-2-methylsulfanylpyrimidine-4-carboxamide
CID 24653889
2-amino-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide;hydrochloride
CID 119315270
methyl (2S)-2-amino-2-(3,4-dichlorophenyl)propanoate
CID 93311074
methyl (2R)-2-amino-2-(3,4-dichlorophenyl)propanoate
CID 93311073
2-amino-N-[2-methyl-2-(4-methylsulfanylphenyl)propyl]acetamide
CID 115151844
2-amino-N-[3-(3-chlorophenyl)-2,2-dimethylpropyl]acetamide
CID 119339868
2-(3,4-dichlorophenyl)-2-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 49320012

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide?
The IUPAC name of 2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide (CID 69398154) is 2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide?
The canonical SMILES for 2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide is CC(CNC(=O)CN)(c1ccccc1)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of 2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide?
The InChIKey is SETNTZYHTXZKIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O/c1-17(11-21-16(22)10-20,12-5-3-2-4-6-12)13-7-8-14(18)15(19)9-13/h2-9H,10-11,20H2,1H3,(H,21,22).
What are the key properties of 2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide?
2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide has a molecular weight of 337.25 g/mol, XLogP of 3.37, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(3,4-dichlorophenyl)-2-phenylpropyl]acetamide is sourced from PubChem (CID 69398154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).