3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide

C16H26N2O2 — CID 109015061

IUPAC3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide
SMILESCCc1cccc(CC)c1NCCC(=O)NCCOC
InChIInChI=1S/C16H26N2O2/c1-4-13-7-6-8-14(5-2)16(13)18-10-9-15(19)17-11-12-20-3/h6-8,18H,4-5,9-12H2,1-3H3,(H,17,19)
InChIKeyJONZIGLUDDQOND-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.38
Rot. Bonds9

About 3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide

3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide (PubChem CID 109015061) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide
PubChem CID109015061
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide
SMILESCCc1cccc(CC)c1NCCC(=O)NCCOC
InChIInChI=1S/C16H26N2O2/c1-4-13-7-6-8-14(5-2)16(13)18-10-9-15(19)17-11-12-20-3/h6-8,18H,4-5,9-12H2,1-3H3,(H,17,19)
InChIKeyJONZIGLUDDQOND-UHFFFAOYSA-N
XLogP2.38
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2,6-dichloroanilino)-N-(2-methoxyethyl)propanamide
CID 109015134
3-(2,6-diethylanilino)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 109025794
2,6-diethyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]aniline
CID 104562158
3-(2,6-diethylanilino)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 109024995
N-(2-methoxyethyl)-3-(2,4,6-trimethylanilino)propanamide
CID 109015060
N-(2-methoxyethyl)-3-(3-methylanilino)propanamide
CID 109015044
N-butyl-3-(2-ethyl-6-methylanilino)propanamide
CID 109012269
2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline
CID 103409479
4-N-(2,6-diethylphenyl)-1-N-(2-methoxyethyl)benzene-1,4-dicarboxamide
CID 109045164
N-(2-methoxyethyl)-3-(4-methylanilino)propanamide
CID 109015045
3-(2-amino-3-methylanilino)-N-(2-methoxyethyl)propanamide
CID 114041350
3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide
CID 109037115

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide?
The IUPAC name of 3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide (CID 109015061) is 3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide is CCc1cccc(CC)c1NCCC(=O)NCCOC.
What is the InChIKey of 3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide?
The InChIKey is JONZIGLUDDQOND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-4-13-7-6-8-14(5-2)16(13)18-10-9-15(19)17-11-12-20-3/h6-8,18H,4-5,9-12H2,1-3H3,(H,17,19).
What are the key properties of 3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide?
3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide has a molecular weight of 278.40 g/mol, XLogP of 2.38, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 109015061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).