2-(benzylamino)-N,N-diethylpropanamide

C14H22N2O — CID 43112479

IUPAC2-(benzylamino)-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)NCc1ccccc1
InChIInChI=1S/C14H22N2O/c1-4-16(5-2)14(17)12(3)15-11-13-9-7-6-8-10-13/h6-10,12,15H,4-5,11H2,1-3H3
InChIKeyCOLIJPZFCAPCGT-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.03
Rot. Bonds6

About 2-(benzylamino)-N,N-diethylpropanamide

2-(benzylamino)-N,N-diethylpropanamide (PubChem CID 43112479) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(benzylamino)-N,N-diethylpropanamide.

Molecular Properties

Compound Name2-(benzylamino)-N,N-diethylpropanamide
PubChem CID43112479
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(benzylamino)-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)NCc1ccccc1
InChIInChI=1S/C14H22N2O/c1-4-16(5-2)14(17)12(3)15-11-13-9-7-6-8-10-13/h6-10,12,15H,4-5,11H2,1-3H3
InChIKeyCOLIJPZFCAPCGT-UHFFFAOYSA-N
XLogP2.03
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide
CID 43739384
N,N-diethyl-2-[(4-fluorophenyl)methylamino]propanamide
CID 43112620
N,N-diethyl-2-[(3,4,5-trifluorophenyl)methylamino]propanamide
CID 63051555
2-[(4-bromo-3-methylphenyl)methylamino]-N,N-diethylpropanamide
CID 66473610
(2R)-2-(benzylamino)propanoyl chloride
CID 166639498
N,N-diethyl-2-(4-phenylbutan-2-ylamino)propanamide
CID 43425172
2-[(2-cyanophenyl)methylamino]-N,N-diethylpropanamide
CID 103851440
N,N-diethyl-2-[(1-propylpyrrol-3-yl)methylamino]propanamide
CID 66413975
2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-N,N-diethylpropanamide
CID 43424955
N,N-diethyl-2-[(2-nitrophenyl)methylamino]propanamide
CID 43739340
N,N-diethyl-2-[(4-methoxy-3-methylphenyl)methylamino]propanamide
CID 43789807
(2S)-2-amino-N-[1-(diethylamino)-1-oxopropan-2-yl]-3-phenylpropanamide
CID 61153941

Frequently Asked Questions

What is the IUPAC name of 2-(benzylamino)-N,N-diethylpropanamide?
The IUPAC name of 2-(benzylamino)-N,N-diethylpropanamide (CID 43112479) is 2-(benzylamino)-N,N-diethylpropanamide.
What is the SMILES notation for 2-(benzylamino)-N,N-diethylpropanamide?
The canonical SMILES for 2-(benzylamino)-N,N-diethylpropanamide is CCN(CC)C(=O)C(C)NCc1ccccc1.
What is the InChIKey of 2-(benzylamino)-N,N-diethylpropanamide?
The InChIKey is COLIJPZFCAPCGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-16(5-2)14(17)12(3)15-11-13-9-7-6-8-10-13/h6-10,12,15H,4-5,11H2,1-3H3.
What are the key properties of 2-(benzylamino)-N,N-diethylpropanamide?
2-(benzylamino)-N,N-diethylpropanamide has a molecular weight of 234.34 g/mol, XLogP of 2.03, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzylamino)-N,N-diethylpropanamide is sourced from PubChem (CID 43112479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).