4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide

C15H24N2O2 — CID 106910220

IUPAC4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide
SMILESCCNCc1ccc(NC(=O)CCCOCC)cc1
InChIInChI=1S/C15H24N2O2/c1-3-16-12-13-7-9-14(10-8-13)17-15(18)6-5-11-19-4-2/h7-10,16H,3-6,11-12H2,1-2H3,(H,17,18)
InChIKeyBLYJAGHUFHPBQS-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.55
Rot. Bonds9

About 4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide

4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide (PubChem CID 106910220) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide.

Molecular Properties

Compound Name4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide
PubChem CID106910220
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide
SMILESCCNCc1ccc(NC(=O)CCCOCC)cc1
InChIInChI=1S/C15H24N2O2/c1-3-16-12-13-7-9-14(10-8-13)17-15(18)6-5-11-19-4-2/h7-10,16H,3-6,11-12H2,1-2H3,(H,17,18)
InChIKeyBLYJAGHUFHPBQS-UHFFFAOYSA-N
XLogP2.55
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.55
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

4-ethoxy-N-phenylbutanamide
CID 112728021
4-ethoxy-N-[3-(propylaminomethyl)phenyl]butanamide
CID 106910729
1-[4-(4-ethoxybutanoylamino)phenyl]cyclopropane-1-carboxylic acid
CID 115912886
4-(4-ethylphenoxy)-N-(4-ethylphenyl)butanamide
CID 19173503
3-[4-(4-ethoxybutanoylamino)phenoxy]propyl methanesulfonate
CID 139895589
N-(4-chlorophenyl)-3-ethoxypropanamide
CID 2972757
2-bromo-5-(4-ethoxybutanoylamino)benzoic acid
CID 113281018
N-[4-[[[(3-ethoxypropylamino)-(ethylamino)methylidene]amino]methyl]phenyl]butanamide
CID 111224573
N-[4-(ethylaminomethyl)phenyl]-3-methylpentanamide
CID 106910059
N-[4-[(propan-2-ylamino)methyl]phenyl]pentanamide
CID 106910393
2-[4-(butanoylamino)phenyl]ethyl formate
CID 87851880
ethyl 5-(4-ethylanilino)-5-oxopentanoate
CID 91711023

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide?
The IUPAC name of 4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide (CID 106910220) is 4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide.
What is the SMILES notation for 4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide?
The canonical SMILES for 4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide is CCNCc1ccc(NC(=O)CCCOCC)cc1.
What is the InChIKey of 4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide?
The InChIKey is BLYJAGHUFHPBQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-16-12-13-7-9-14(10-8-13)17-15(18)6-5-11-19-4-2/h7-10,16H,3-6,11-12H2,1-2H3,(H,17,18).
What are the key properties of 4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide?
4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide has a molecular weight of 264.37 g/mol, XLogP of 2.55, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[4-(ethylaminomethyl)phenyl]butanamide is sourced from PubChem (CID 106910220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).