2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide

C13H19NO3 — CID 115139677

IUPAC2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide
SMILESCOc1ccc(N(C)C(=O)CO)cc1C(C)C
InChIInChI=1S/C13H19NO3/c1-9(2)11-7-10(5-6-12(11)17-4)14(3)13(16)8-15/h5-7,9,15H,8H2,1-4H3
InChIKeyNUEVTSNAQPKQKV-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.77
Rot. Bonds4

About 2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide

2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide (PubChem CID 115139677) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide.

Molecular Properties

Compound Name2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide
PubChem CID115139677
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide
SMILESCOc1ccc(N(C)C(=O)CO)cc1C(C)C
InChIInChI=1S/C13H19NO3/c1-9(2)11-7-10(5-6-12(11)17-4)14(3)13(16)8-15/h5-7,9,15H,8H2,1-4H3
InChIKeyNUEVTSNAQPKQKV-UHFFFAOYSA-N
XLogP1.77
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide
CID 115161877
2-(4-methoxy-N-methyl-3-propan-2-ylanilino)acetamide
CID 115259761
N-(3-methoxy-4-propan-2-ylphenyl)-N,3,3-trimethylbutanamide
CID 21025600
4-methoxy-N-(methoxymethyl)-N-methyl-3-propan-2-ylaniline
CID 115258339
(E)-4-(4-methoxy-N-methyl-3-propan-2-ylanilino)but-2-enoic acid
CID 115236974
2-hydroxy-N-(3-methoxyphenyl)-N-methylacetamide
CID 70581132
2-N-(4-methoxy-3-propan-2-ylphenyl)-2-N,3-dimethylbutane-1,2-diamine
CID 115138007
methyl 3-(3,4-dimethoxy-N-methylanilino)-3-oxopropanoate
CID 115174204
N-(3,4-dimethoxyphenyl)-N,3,3-trimethylbutanamide
CID 110425453
N-(4-methoxy-3-propan-2-ylphenyl)-N,2-dimethylbutane-1,4-diamine
CID 115202419
N-[(4-methoxy-3-propan-2-ylphenyl)methyl]-N-methyl-2-oxoacetamide
CID 115166361
4-[(4-methoxy-3-propan-2-ylphenyl)methyl-methylamino]butan-1-ol
CID 115217660

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide?
The IUPAC name of 2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide (CID 115139677) is 2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide.
What is the SMILES notation for 2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide?
The canonical SMILES for 2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide is COc1ccc(N(C)C(=O)CO)cc1C(C)C.
What is the InChIKey of 2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide?
The InChIKey is NUEVTSNAQPKQKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-9(2)11-7-10(5-6-12(11)17-4)14(3)13(16)8-15/h5-7,9,15H,8H2,1-4H3.
What are the key properties of 2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide?
2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide has a molecular weight of 237.30 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(4-methoxy-3-propan-2-ylphenyl)-N-methylacetamide is sourced from PubChem (CID 115139677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).