4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide

C12H17NO3 — CID 79191908

IUPAC4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide
SMILESCOc1ccc(N(C)C(=O)CCCO)cc1
InChIInChI=1S/C12H17NO3/c1-13(12(15)4-3-9-14)10-5-7-11(16-2)8-6-10/h5-8,14H,3-4,9H2,1-2H3
InChIKeyGYWJWXYXKLZODS-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.43
Rot. Bonds5

About 4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide

4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide (PubChem CID 79191908) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is 4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide.

Molecular Properties

Compound Name4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide
PubChem CID79191908
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Name4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide
SMILESCOc1ccc(N(C)C(=O)CCCO)cc1
InChIInChI=1S/C12H17NO3/c1-13(12(15)4-3-9-14)10-5-7-11(16-2)8-6-10/h5-8,14H,3-4,9H2,1-2H3
InChIKeyGYWJWXYXKLZODS-UHFFFAOYSA-N
XLogP1.43
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-tert-butylphenyl)-4-hydroxy-N-methylbutanamide
CID 115162843
2-chloro-N-(4-methoxyphenyl)-N-methylacetamide
CID 4714233
5-(4-methoxyphenyl)-N-methyl-5-oxo-N-phenylpentanamide
CID 110298230
4-hydroxy-N-methyl-N-pyridin-4-ylbutanamide
CID 106937601
N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide
CID 172554773
3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide
CID 100772393
(4-methoxyphenyl)-methylcarbamic acid
CID 22047987
N-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605370
N-(2,4-dimethoxy-6-methylphenyl)-4-hydroxy-N-methylbutanamide
CID 115162936
N-(4-ethoxy-3-methylphenyl)-4-hydroxy-N-methylbutanamide
CID 115162888
N-(4-methoxyphenyl)-N-methyl-2-pyridin-4-ylacetamide
CID 110468130
N-(4-methoxyphenyl)-N-methyl-2-(4-sulfanylphenyl)acetamide
CID 107027641

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide?
The IUPAC name of 4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide (CID 79191908) is 4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide.
What is the SMILES notation for 4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide?
The canonical SMILES for 4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide is COc1ccc(N(C)C(=O)CCCO)cc1.
What is the InChIKey of 4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide?
The InChIKey is GYWJWXYXKLZODS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-13(12(15)4-3-9-14)10-5-7-11(16-2)8-6-10/h5-8,14H,3-4,9H2,1-2H3.
What are the key properties of 4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide?
4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide has a molecular weight of 223.27 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide is sourced from PubChem (CID 79191908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).