N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide

C15H21NO3 — CID 110876397

IUPACN-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide
SMILESCOc1ccc(NC(=O)C(C)C2CCOCC2)cc1
InChIInChI=1S/C15H21NO3/c1-11(12-7-9-19-10-8-12)15(17)16-13-3-5-14(18-2)6-4-13/h3-6,11-12H,7-10H2,1-2H3,(H,16,17)
InChIKeyAVIQDADSCLQENG-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.70
Rot. Bonds4

About N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide

N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide (PubChem CID 110876397) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide
PubChem CID110876397
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide
SMILESCOc1ccc(NC(=O)C(C)C2CCOCC2)cc1
InChIInChI=1S/C15H21NO3/c1-11(12-7-9-19-10-8-12)15(17)16-13-3-5-14(18-2)6-4-13/h3-6,11-12H,7-10H2,1-2H3,(H,16,17)
InChIKeyAVIQDADSCLQENG-UHFFFAOYSA-N
XLogP2.70
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(oxan-4-yl)propanoylamino]benzoic acid
CID 120684653
4-[[2-amino-2-(oxan-4-yl)acetyl]amino]-N-(4-methoxyphenyl)benzamide;hydrochloride
CID 120782841
2-methyl-5-[2-(oxan-4-yl)propanoylamino]benzoic acid
CID 120688109
N-[(4-methoxy-2-methylphenyl)methyl]-2-(oxan-4-yl)propanamide
CID 75433024
2-amino-N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120801081
2-amino-N-(3,5-dimethoxyphenyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120782987
methyl 2-(4-methoxyanilino)-2-(oxolan-3-yl)acetate
CID 54889486
(2S)-2-(cyclohexylmethylamino)-N-(4-methoxyphenyl)propanamide
CID 2351355
2-cyclopropyl-N-[4-(1-hydroxyethyl)phenyl]propanamide
CID 83148427
2-amino-N-[4-(4-ethoxyphenoxy)phenyl]-2-(oxan-4-yl)acetamide
CID 120783556
(2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide
CID 97244143
2-amino-2-(oxan-4-yl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide
CID 120785656

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide (CID 110876397) is N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide is COc1ccc(NC(=O)C(C)C2CCOCC2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide?
The InChIKey is AVIQDADSCLQENG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-11(12-7-9-19-10-8-12)15(17)16-13-3-5-14(18-2)6-4-13/h3-6,11-12H,7-10H2,1-2H3,(H,16,17).
What are the key properties of N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide?
N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide has a molecular weight of 263.34 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide is sourced from PubChem (CID 110876397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).