N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide

C16H26N2O — CID 43739384

IUPACN,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide
SMILESCCc1ccc(CNC(C)C(=O)N(CC)CC)cc1
InChIInChI=1S/C16H26N2O/c1-5-14-8-10-15(11-9-14)12-17-13(4)16(19)18(6-2)7-3/h8-11,13,17H,5-7,12H2,1-4H3
InChIKeySYXYUIRKNLEVKJ-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.60
Rot. Bonds7

About N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide

N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide (PubChem CID 43739384) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide.

Molecular Properties

Compound NameN,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide
PubChem CID43739384
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide
SMILESCCc1ccc(CNC(C)C(=O)N(CC)CC)cc1
InChIInChI=1S/C16H26N2O/c1-5-14-8-10-15(11-9-14)12-17-13(4)16(19)18(6-2)7-3/h8-11,13,17H,5-7,12H2,1-4H3
InChIKeySYXYUIRKNLEVKJ-UHFFFAOYSA-N
XLogP2.60
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethyl-2-[(4-fluorophenyl)methylamino]propanamide
CID 43112620
2-(benzylamino)-N,N-diethylpropanamide
CID 43112479
2-[(4-bromo-3-methylphenyl)methylamino]-N,N-diethylpropanamide
CID 66473610
2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-N,N-diethylpropanamide
CID 43424955
N,N-diethyl-2-[(3,4,5-trifluorophenyl)methylamino]propanamide
CID 63051555
N,N-diethyl-2-[(4-methoxy-3-methylphenyl)methylamino]propanamide
CID 43789807
2-[(3-bromo-4-methoxyphenyl)methylamino]-N,N-diethylpropanamide
CID 43789766
N-ethyl-2-[[4-(hydroxymethyl)phenyl]methylamino]-N-methylpropanamide
CID 103108687
N,N-diethyl-2-[(1-propylpyrrol-3-yl)methylamino]propanamide
CID 66413975
2-[(4-bromophenyl)methylamino]-N-ethyl-N-methylpropanamide
CID 103107208
1-(4-ethylphenyl)-2-[(4-methylphenyl)methylamino]propan-1-one
CID 82100240
tert-butyl 2-[(4-ethylphenyl)methylamino]propanoate
CID 70950358

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide?
The IUPAC name of N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide (CID 43739384) is N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide.
What is the SMILES notation for N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide?
The canonical SMILES for N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide is CCc1ccc(CNC(C)C(=O)N(CC)CC)cc1.
What is the InChIKey of N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide?
The InChIKey is SYXYUIRKNLEVKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-5-14-8-10-15(11-9-14)12-17-13(4)16(19)18(6-2)7-3/h8-11,13,17H,5-7,12H2,1-4H3.
What are the key properties of N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide?
N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide has a molecular weight of 262.40 g/mol, XLogP of 2.60, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[(4-ethylphenyl)methylamino]propanamide is sourced from PubChem (CID 43739384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).