N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide

C22H30N2O — CID 11544630

IUPACN-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide
SMILESCCCc1ccccc1C(=O)NC(c1ccccc1)C(C)(C)N(C)C
InChIInChI=1S/C22H30N2O/c1-6-12-17-13-10-11-16-19(17)21(25)23-20(22(2,3)24(4)5)18-14-8-7-9-15-18/h7-11,13-16,20H,6,12H2,1-5H3,(H,23,25)
InChIKeyBBPSMOCHEGBMHK-UHFFFAOYSA-N
MW338.50 g/mol
LogP4.45
Rot. Bonds7

About N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide

N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide (PubChem CID 11544630) has the molecular formula C22H30N2O and a molecular weight of 338.50 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide
PubChem CID11544630
Molecular FormulaC22H30N2O
Molecular Weight338.50 g/mol
Exact Mass338.24
IUPAC NameN-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide
SMILESCCCc1ccccc1C(=O)NC(c1ccccc1)C(C)(C)N(C)C
InChIInChI=1S/C22H30N2O/c1-6-12-17-13-10-11-16-19(17)21(25)23-20(22(2,3)24(4)5)18-14-8-7-9-15-18/h7-11,13-16,20H,6,12H2,1-5H3,(H,23,25)
InChIKeyBBPSMOCHEGBMHK-UHFFFAOYSA-N
XLogP4.45
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.50
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3-dimethylbenzamide
CID 11558867
2-propylbenzohydrazide
CID 140653675
N-(2,2-dimethyl-1-phenylpropyl)-2-methylsulfanylbenzamide
CID 112820701
N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3,3-trimethylcyclohexa-1,5-diene-1-carboxamide
CID 143249841
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
1-N,2-N,2-N,2-tetramethyl-1-phenylpropane-1,2-diamine
CID 79053709
2-hydroxy-1,2-diphenylethanone;2-hydroxy-2-phenyl-1-(2-propylphenyl)ethanone
CID 159551981
N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2,3,6-trimethylcyclohexa-1,3-diene-1-carboxamide
CID 143249853
(2R)-2-[(2-pentylbenzoyl)amino]-3-sulfanylpropanoic acid
CID 142708966
N-(2-chloro-1-phenylethyl)-2-ethylbenzamide
CID 114300081
N-[(1R)-2,2-dimethyl-1-phenylpropyl]benzamide
CID 51940794

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide?
The IUPAC name of N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide (CID 11544630) is N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide?
The canonical SMILES for N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide is CCCc1ccccc1C(=O)NC(c1ccccc1)C(C)(C)N(C)C.
What is the InChIKey of N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide?
The InChIKey is BBPSMOCHEGBMHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O/c1-6-12-17-13-10-11-16-19(17)21(25)23-20(22(2,3)24(4)5)18-14-8-7-9-15-18/h7-11,13-16,20H,6,12H2,1-5H3,(H,23,25).
What are the key properties of N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide?
N-[2-(dimethylamino)-2-methyl-1-phenylpropyl]-2-propylbenzamide has a molecular weight of 338.50 g/mol, XLogP of 4.45, 7 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-propylbenzamide is sourced from PubChem (CID 11544630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).