N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide

C14H19NO4 — CID 166118272

IUPACN-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide
SMILESCCCC(O)C(=O)N(C=O)Cc1ccc(OC)cc1
InChIInChI=1S/C14H19NO4/c1-3-4-13(17)14(18)15(10-16)9-11-5-7-12(19-2)8-6-11/h5-8,10,13,17H,3-4,9H2,1-2H3
InChIKeyHBIFDGNBJPDFFG-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.34
Rot. Bonds7

About N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide

N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide (PubChem CID 166118272) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide.

Molecular Properties

Compound NameN-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide
PubChem CID166118272
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC NameN-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide
SMILESCCCC(O)C(=O)N(C=O)Cc1ccc(OC)cc1
InChIInChI=1S/C14H19NO4/c1-3-4-13(17)14(18)15(10-16)9-11-5-7-12(19-2)8-6-11/h5-8,10,13,17H,3-4,9H2,1-2H3
InChIKeyHBIFDGNBJPDFFG-UHFFFAOYSA-N
XLogP1.34
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-amino-N-ethyl-N-[(4-methoxyphenyl)methyl]pentanamide
CID 93372926
2-amino-N-[(4-methoxyphenyl)methyl]-N-methylpentanamide;hydrochloride
CID 119266470
ethyl (2R)-2-hydroxy-4-(4-methoxyphenyl)butanoate
CID 102317664
1-(4-methoxyphenyl)pentan-2-ol
CID 61375325
1-(4-methoxyphenyl)-3-propylhexan-2-one
CID 82986928
4-amino-N-[(4-methoxyphenyl)methyl]-N,2-dimethylbutanamide
CID 80542826
(2R)-2-[[(4-methoxyphenyl)methyl-methylcarbamoyl]amino]pentanoic acid
CID 107566389
2-(aminomethyl)-N-ethyl-N-[(4-methoxyphenyl)methyl]butanamide
CID 65227293
N-[(4-methoxyphenyl)methyl]-N-methylpropan-1-amine
CID 122609914
2-bromo-N-formyl-N-(2-methoxyethyl)-5-(4-methoxyphenyl)pentanamide
CID 143097102
4-amino-N-ethyl-N-[(4-methoxyphenyl)methyl]pentanamide;hydrochloride
CID 120560791
5-amino-N-[(4-methoxyphenyl)methyl]-N,4-dimethylpentanamide
CID 82012231

Frequently Asked Questions

What is the IUPAC name of N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide?
The IUPAC name of N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide (CID 166118272) is N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide.
What is the SMILES notation for N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide?
The canonical SMILES for N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide is CCCC(O)C(=O)N(C=O)Cc1ccc(OC)cc1.
What is the InChIKey of N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide?
The InChIKey is HBIFDGNBJPDFFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-3-4-13(17)14(18)15(10-16)9-11-5-7-12(19-2)8-6-11/h5-8,10,13,17H,3-4,9H2,1-2H3.
What are the key properties of N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide?
N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide has a molecular weight of 265.31 g/mol, XLogP of 1.34, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-formyl-2-hydroxy-N-[(4-methoxyphenyl)methyl]pentanamide is sourced from PubChem (CID 166118272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).