N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide

C16H26N2O2 — CID 3025328

IUPACN-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide
SMILESCCc1ccccc1NC(=O)C(C)NCC(CC)OC
InChIInChI=1S/C16H26N2O2/c1-5-13-9-7-8-10-15(13)18-16(19)12(3)17-11-14(6-2)20-4/h7-10,12,14,17H,5-6,11H2,1-4H3,(H,18,19)
InChIKeyQYSXRCBRAZEXKP-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.59
Rot. Bonds8

About N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide

N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide (PubChem CID 3025328) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide
PubChem CID3025328
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide
SMILESCCc1ccccc1NC(=O)C(C)NCC(CC)OC
InChIInChI=1S/C16H26N2O2/c1-5-13-9-7-8-10-15(13)18-16(19)12(3)17-11-14(6-2)20-4/h7-10,12,14,17H,5-6,11H2,1-4H3,(H,18,19)
InChIKeyQYSXRCBRAZEXKP-UHFFFAOYSA-N
XLogP2.59
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide?
The IUPAC name of N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide (CID 3025328) is N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide.
What is the SMILES notation for N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide?
The canonical SMILES for N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide is CCc1ccccc1NC(=O)C(C)NCC(CC)OC.
What is the InChIKey of N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide?
The InChIKey is QYSXRCBRAZEXKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-5-13-9-7-8-10-15(13)18-16(19)12(3)17-11-14(6-2)20-4/h7-10,12,14,17H,5-6,11H2,1-4H3,(H,18,19).
What are the key properties of N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide?
N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide has a molecular weight of 278.40 g/mol, XLogP of 2.59, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-(2-methoxybutylamino)propanamide is sourced from PubChem (CID 3025328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).