3-amino-N-benzyl-N-methyl-2-phenylpropanamide

C17H20N2O — CID 62878331

IUPAC3-amino-N-benzyl-N-methyl-2-phenylpropanamide
SMILESCN(Cc1ccccc1)C(=O)C(CN)c1ccccc1
InChIInChI=1S/C17H20N2O/c1-19(13-14-8-4-2-5-9-14)17(20)16(12-18)15-10-6-3-7-11-15/h2-11,16H,12-13,18H2,1H3
InChIKeyHWSQHKHCDXKLEO-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.39
Rot. Bonds5

About 3-amino-N-benzyl-N-methyl-2-phenylpropanamide

3-amino-N-benzyl-N-methyl-2-phenylpropanamide (PubChem CID 62878331) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-amino-N-benzyl-N-methyl-2-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-benzyl-N-methyl-2-phenylpropanamide
PubChem CID62878331
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name3-amino-N-benzyl-N-methyl-2-phenylpropanamide
SMILESCN(Cc1ccccc1)C(=O)C(CN)c1ccccc1
InChIInChI=1S/C17H20N2O/c1-19(13-14-8-4-2-5-9-14)17(20)16(12-18)15-10-6-3-7-11-15/h2-11,16H,12-13,18H2,1H3
InChIKeyHWSQHKHCDXKLEO-UHFFFAOYSA-N
XLogP2.39
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-methyl-2-phenyl-N-(pyridin-3-ylmethyl)propanamide;dihydrochloride
CID 119958250
3-amino-N-[(2-hydroxyphenyl)methyl]-N-methyl-2-phenylpropanamide
CID 62878721
3-amino-N-[[4-(difluoromethoxy)phenyl]methyl]-N-methyl-2-phenylpropanamide;hydrochloride
CID 119681798
3-amino-N-(2-amino-2-oxoethyl)-N-methyl-2-phenylpropanamide
CID 62877301
(2S)-3-amino-N,N-dimethyl-2-phenylpropanamide
CID 94888711
3-amino-N-(furan-2-ylmethyl)-N-methyl-2-phenylpropanamide
CID 62878878
3-amino-N-[(5-bromofuran-2-yl)methyl]-N-methyl-2-phenylpropanamide
CID 62877834
acetic acid;N-benzyl-2-hydroxy-N-methyl-2-phenylacetamide
CID 67863072
3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide
CID 62878205
3-amino-N,N-diethyl-2-phenylpropanamide
CID 62876932
3-amino-N-butan-2-yl-N-methyl-2-phenylpropanamide
CID 62879219
3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride
CID 119770662

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-benzyl-N-methyl-2-phenylpropanamide?
The IUPAC name of 3-amino-N-benzyl-N-methyl-2-phenylpropanamide (CID 62878331) is 3-amino-N-benzyl-N-methyl-2-phenylpropanamide.
What is the SMILES notation for 3-amino-N-benzyl-N-methyl-2-phenylpropanamide?
The canonical SMILES for 3-amino-N-benzyl-N-methyl-2-phenylpropanamide is CN(Cc1ccccc1)C(=O)C(CN)c1ccccc1.
What is the InChIKey of 3-amino-N-benzyl-N-methyl-2-phenylpropanamide?
The InChIKey is HWSQHKHCDXKLEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-19(13-14-8-4-2-5-9-14)17(20)16(12-18)15-10-6-3-7-11-15/h2-11,16H,12-13,18H2,1H3.
What are the key properties of 3-amino-N-benzyl-N-methyl-2-phenylpropanamide?
3-amino-N-benzyl-N-methyl-2-phenylpropanamide has a molecular weight of 268.36 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-benzyl-N-methyl-2-phenylpropanamide is sourced from PubChem (CID 62878331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).