N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide

C19H24N2O — CID 78819640

IUPACN-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide
SMILESCc1cccc(C(=O)NC(CN(C)C)c2ccccc2)c1C
InChIInChI=1S/C19H24N2O/c1-14-9-8-12-17(15(14)2)19(22)20-18(13-21(3)4)16-10-6-5-7-11-16/h5-12,18H,13H2,1-4H3,(H,20,22)
InChIKeyLCELZKFDMPSITM-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.34
Rot. Bonds5

About N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide

N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide (PubChem CID 78819640) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide
PubChem CID78819640
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC NameN-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide
SMILESCc1cccc(C(=O)NC(CN(C)C)c2ccccc2)c1C
InChIInChI=1S/C19H24N2O/c1-14-9-8-12-17(15(14)2)19(22)20-18(13-21(3)4)16-10-6-5-7-11-16/h5-12,18H,13H2,1-4H3,(H,20,22)
InChIKeyLCELZKFDMPSITM-UHFFFAOYSA-N
XLogP3.34
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(dimethylamino)-1-phenylethyl]-3-methylthiophene-2-carboxamide
CID 86909665
(2S)-2-[(2,3-dimethylbenzoyl)amino]-2-phenylacetic acid
CID 30123282
2-chloro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-methylbenzamide
CID 103945018
4-chloro-N-[(1R)-2-(dimethylamino)-1-phenylethyl]benzamide
CID 8936052
N-[2-(dimethylamino)-1-phenylethyl]-6-methylpyridine-2-carboxamide
CID 78845972
N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide
CID 11558867
N-[2-(dimethylamino)-3-hydroxy-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide
CID 59347868
2-chloro-N-[2-(dimethylamino)-1-phenylethyl]furan-3-carboxamide
CID 106686543
N-[(1R)-2-(dimethylamino)-1-phenylethyl]-5-methyl-1-phenylpyrazole-4-carboxamide
CID 34464052
2-chloro-N-[2-(dimethylamino)-1-phenylethyl]-5-methylsulfonylbenzamide
CID 78819751
N-[cyano(phenyl)methyl]-2,3-dimethylbenzamide
CID 60659253
2-[(2,3-dimethylbenzoyl)amino]-3-phenylpropanoic acid
CID 16786218

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide?
The IUPAC name of N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide (CID 78819640) is N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide.
What is the SMILES notation for N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide?
The canonical SMILES for N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide is Cc1cccc(C(=O)NC(CN(C)C)c2ccccc2)c1C.
What is the InChIKey of N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide?
The InChIKey is LCELZKFDMPSITM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-14-9-8-12-17(15(14)2)19(22)20-18(13-21(3)4)16-10-6-5-7-11-16/h5-12,18H,13H2,1-4H3,(H,20,22).
What are the key properties of N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide?
N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide has a molecular weight of 296.41 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide is sourced from PubChem (CID 78819640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).