N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide

C22H30N2O — CID 134022161

IUPACN-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide
SMILESCCN(CC)Cc1ccccc1CNC(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C22H30N2O/c1-5-24(6-2)17-19-13-11-10-12-18(19)16-23-21(25)22(3,4)20-14-8-7-9-15-20/h7-15H,5-6,16-17H2,1-4H3,(H,23,25)
InChIKeyVCGLKCQWNCVMTG-UHFFFAOYSA-N
MW338.50 g/mol
LogP4.12
Rot. Bonds8

About N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide

N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide (PubChem CID 134022161) has the molecular formula C22H30N2O and a molecular weight of 338.50 g/mol. Its IUPAC name is N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide.

Molecular Properties

Compound NameN-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide
PubChem CID134022161
Molecular FormulaC22H30N2O
Molecular Weight338.50 g/mol
Exact Mass338.24
IUPAC NameN-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide
SMILESCCN(CC)Cc1ccccc1CNC(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C22H30N2O/c1-5-24(6-2)17-19-13-11-10-12-18(19)16-23-21(25)22(3,4)20-14-8-7-9-15-20/h7-15H,5-6,16-17H2,1-4H3,(H,23,25)
InChIKeyVCGLKCQWNCVMTG-UHFFFAOYSA-N
XLogP4.12
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.50
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide
CID 60674556
(2S)-2-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]-3,3-dimethylbutanamide
CID 119836094
3-[[2-(diethylaminomethyl)phenyl]methylamino]-2-methyl-3-oxopropanoic acid
CID 114897128
2-tert-butylsulfanyl-N-[[2-(diethylaminomethyl)phenyl]methyl]acetamide
CID 134022151
2-chloro-N-[[2-(diethylaminomethyl)phenyl]methyl]propanamide
CID 43346662
N-[[2-(diethylaminomethyl)phenyl]methyl]-2-ethoxyacetamide
CID 60676604
(2S)-2-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]-3-methylbutanamide
CID 61259162
1-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]cyclopropane-1-carboxamide;dihydrochloride
CID 119836037
N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methylsulfonylbenzamide
CID 31311834
1-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]cyclobutane-1-carboxamide
CID 81171767
4-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methylbutanamide
CID 80542266
N-[[2-(diethylaminomethyl)phenyl]methyl]-2,2-dimethylpropan-1-amine
CID 61324923

Frequently Asked Questions

What is the IUPAC name of N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide?
The IUPAC name of N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide (CID 134022161) is N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide.
What is the SMILES notation for N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide?
The canonical SMILES for N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide is CCN(CC)Cc1ccccc1CNC(=O)C(C)(C)c1ccccc1.
What is the InChIKey of N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide?
The InChIKey is VCGLKCQWNCVMTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O/c1-5-24(6-2)17-19-13-11-10-12-18(19)16-23-21(25)22(3,4)20-14-8-7-9-15-20/h7-15H,5-6,16-17H2,1-4H3,(H,23,25).
What are the key properties of N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide?
N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide has a molecular weight of 338.50 g/mol, XLogP of 4.12, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(diethylaminomethyl)phenyl]methyl]-2-methyl-2-phenylpropanamide is sourced from PubChem (CID 134022161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).