N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide

C15H24N2O3 — CID 82315404

IUPACN-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(O)C(C)NCCOC)cc1
InChIInChI=1S/C15H24N2O3/c1-4-14(18)17-13-7-5-12(6-8-13)15(19)11(2)16-9-10-20-3/h5-8,11,15-16,19H,4,9-10H2,1-3H3,(H,17,18)
InChIKeyNOPSEVBUUJLWKT-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.69
Rot. Bonds8

About N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide

N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide (PubChem CID 82315404) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide.

Molecular Properties

Compound NameN-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide
PubChem CID82315404
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(O)C(C)NCCOC)cc1
InChIInChI=1S/C15H24N2O3/c1-4-14(18)17-13-7-5-12(6-8-13)15(19)11(2)16-9-10-20-3/h5-8,11,15-16,19H,4,9-10H2,1-3H3,(H,17,18)
InChIKeyNOPSEVBUUJLWKT-UHFFFAOYSA-N
XLogP1.69
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(4-ethylphenyl)-2-(2-methoxyethylamino)propan-1-ol
CID 82312671
N-[4-[1-hydroxy-2-(propan-2-ylamino)propyl]phenyl]propanamide
CID 82315401
N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]propanamide
CID 82315397
3-[[1-(4-acetamidophenyl)-1-hydroxypropan-2-yl]amino]propanoic acid
CID 82314646
1-(3,4-dichlorophenyl)-2-(2-methoxyethylamino)propan-1-ol
CID 82315777
3-(2-methoxyethylamino)-N-(4-propan-2-ylphenyl)propanamide
CID 109015241
N-[4-[1-(methylamino)ethyl]phenyl]propanamide
CID 43507580
N-[4-[1-[(2-chloroacetyl)amino]ethyl]phenyl]propanamide
CID 154832906
1-(4-tert-butylphenyl)-2-(3-methoxypropylamino)propan-1-ol
CID 82313612
2-amino-3-methoxy-N-[4-(propanoylamino)phenyl]propanamide;hydrochloride
CID 120986274
3-[4-(3-methoxypropanoylamino)phenyl]butanoic acid
CID 113419998
N-[4-(propan-2-ylamino)phenyl]propanamide
CID 43720685

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide?
The IUPAC name of N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide (CID 82315404) is N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide.
What is the SMILES notation for N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide?
The canonical SMILES for N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide is CCC(=O)Nc1ccc(C(O)C(C)NCCOC)cc1.
What is the InChIKey of N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide?
The InChIKey is NOPSEVBUUJLWKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-4-14(18)17-13-7-5-12(6-8-13)15(19)11(2)16-9-10-20-3/h5-8,11,15-16,19H,4,9-10H2,1-3H3,(H,17,18).
What are the key properties of N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide?
N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide has a molecular weight of 280.37 g/mol, XLogP of 1.69, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-hydroxy-2-(2-methoxyethylamino)propyl]phenyl]propanamide is sourced from PubChem (CID 82315404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).