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

C21H28N2O — CID 11558867

IUPACN-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide
SMILESCc1cccc(C(=O)NC(c2ccccc2)C(C)(C)N(C)C)c1C
InChIInChI=1S/C21H28N2O/c1-15-11-10-14-18(16(15)2)20(24)22-19(21(3,4)23(5)6)17-12-8-7-9-13-17/h7-14,19H,1-6H3,(H,22,24)
InChIKeyFYOFPIXPPVBCTA-UHFFFAOYSA-N
MW324.47 g/mol
LogP4.11
Rot. Bonds5

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

N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide (PubChem CID 11558867) has the molecular formula C21H28N2O and a molecular weight of 324.47 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide
PubChem CID11558867
Molecular FormulaC21H28N2O
Molecular Weight324.47 g/mol
Exact Mass324.22
IUPAC NameN-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide
SMILESCc1cccc(C(=O)NC(c2ccccc2)C(C)(C)N(C)C)c1C
InChIInChI=1S/C21H28N2O/c1-15-11-10-14-18(16(15)2)20(24)22-19(21(3,4)23(5)6)17-12-8-7-9-13-17/h7-14,19H,1-6H3,(H,22,24)
InChIKeyFYOFPIXPPVBCTA-UHFFFAOYSA-N
XLogP4.11
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.47
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(dimethylamino)-3-hydroxy-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide
CID 59347868
N-[(1S)-2,2-dimethyl-1-phenylpropyl]-2-methylbenzamide
CID 51940796
N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide
CID 11544630
N-[2-(dimethylamino)-1-phenylethyl]-2,3-dimethylbenzamide
CID 78819640
(2S)-2-[(2,3-dimethylbenzoyl)amino]-2-phenylacetic acid
CID 30123282
N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3,6-trimethylcyclohexa-1,3-diene-1-carboxamide
CID 143249853
N-[cyano(phenyl)methyl]-2,3-dimethylbenzamide
CID 60659253
N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3,3-trimethylcyclohexa-1,5-diene-1-carboxamide
CID 143249841
N-(2,2-dimethyl-1-phenylpropyl)-2-methylsulfanylbenzamide
CID 112820701
1-N,2-N,2-N,2-tetramethyl-1-phenylpropane-1,2-diamine
CID 79053709
2,3-dimethyl-N-(2-phenylpropan-2-yl)benzamide
CID 47444747
2-[(2,3-dimethylbenzoyl)amino]-3-phenylpropanoic acid
CID 16786218

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide?
The IUPAC name of N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide (CID 11558867) is N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide?
The canonical SMILES for N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide is Cc1cccc(C(=O)NC(c2ccccc2)C(C)(C)N(C)C)c1C.
What is the InChIKey of N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide?
The InChIKey is FYOFPIXPPVBCTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O/c1-15-11-10-14-18(16(15)2)20(24)22-19(21(3,4)23(5)6)17-12-8-7-9-13-17/h7-14,19H,1-6H3,(H,22,24).
What are the key properties of N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide?
N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide has a molecular weight of 324.47 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide is sourced from PubChem (CID 11558867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).