2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide

C14H22N2O2 — CID 60685142

IUPAC2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide
SMILESCCNC(=O)C(C)N(CCO)Cc1ccccc1
InChIInChI=1S/C14H22N2O2/c1-3-15-14(18)12(2)16(9-10-17)11-13-7-5-4-6-8-13/h4-8,12,17H,3,9-11H2,1-2H3,(H,15,18)
InChIKeyIMUDICPZGQEUQF-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.01
Rot. Bonds7

About 2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide

2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide (PubChem CID 60685142) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide.

Molecular Properties

Compound Name2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide
PubChem CID60685142
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide
SMILESCCNC(=O)C(C)N(CCO)Cc1ccccc1
InChIInChI=1S/C14H22N2O2/c1-3-15-14(18)12(2)16(9-10-17)11-13-7-5-4-6-8-13/h4-8,12,17H,3,9-11H2,1-2H3,(H,15,18)
InChIKeyIMUDICPZGQEUQF-UHFFFAOYSA-N
XLogP1.01
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-aminoethyl(benzyl)amino]-N-ethylpropanamide
CID 54903541
2-[benzyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)propanamide
CID 60685211
2-[benzyl(2-hydroxyethyl)amino]-N-ethyl-2-methoxyacetamide
CID 67629600
2-[benzyl(2-hydroxyethyl)amino]propanoic acid
CID 62115110
ethyl 2-[benzyl(2-hydroxyethyl)amino]propanoate
CID 62116345
2-[benzyl(2-hydroxyethyl)amino]-N,N-dimethylpropanamide
CID 60684942
2-[(4-aminophenyl)methyl-ethylamino]-N-ethylpropanamide
CID 43383877
2-[1-aminopropan-2-yl(benzyl)amino]ethanol
CID 62116860
N'-benzyl-N-ethyl-N'-(2-hydroxyethyl)oxamide
CID 108521418
1-benzyl-3-ethyl-1-propan-2-ylurea
CID 108890429
(2R)-2-(dibenzylamino)propanoic acid
CID 10754456
2-[benzyl-(2-phenylacetyl)amino]-N-(2-hydroxyethyl)propanamide
CID 133148954

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide?
The IUPAC name of 2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide (CID 60685142) is 2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide.
What is the SMILES notation for 2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide?
The canonical SMILES for 2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide is CCNC(=O)C(C)N(CCO)Cc1ccccc1.
What is the InChIKey of 2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide?
The InChIKey is IMUDICPZGQEUQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-15-14(18)12(2)16(9-10-17)11-13-7-5-4-6-8-13/h4-8,12,17H,3,9-11H2,1-2H3,(H,15,18).
What are the key properties of 2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide?
2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide has a molecular weight of 250.34 g/mol, XLogP of 1.01, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(2-hydroxyethyl)amino]-N-ethylpropanamide is sourced from PubChem (CID 60685142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).