ethane;N-(2-hydroxyphenyl)butanamide

C12H19NO2 — CID 142538893

IUPACethane;N-(2-hydroxyphenyl)butanamide
SMILESCC.CCCC(=O)Nc1ccccc1O
InChIInChI=1S/C10H13NO2.C2H6/c1-2-5-10(13)11-8-6-3-4-7-9(8)12;1-2/h3-4,6-7,12H,2,5H2,1H3,(H,11,13);1-2H3
InChIKeyRHLGTAMFRWJEAP-UHFFFAOYSA-N
MW209.29 g/mol
LogP3.16
Rot. Bonds3

About ethane;N-(2-hydroxyphenyl)butanamide

ethane;N-(2-hydroxyphenyl)butanamide (PubChem CID 142538893) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is ethane;N-(2-hydroxyphenyl)butanamide.

Molecular Properties

Compound Nameethane;N-(2-hydroxyphenyl)butanamide
PubChem CID142538893
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Nameethane;N-(2-hydroxyphenyl)butanamide
SMILESCC.CCCC(=O)Nc1ccccc1O
InChIInChI=1S/C10H13NO2.C2H6/c1-2-5-10(13)11-8-6-3-4-7-9(8)12;1-2/h3-4,6-7,12H,2,5H2,1H3,(H,11,13);1-2H3
InChIKeyRHLGTAMFRWJEAP-UHFFFAOYSA-N
XLogP3.16
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(bromomethyl)phenyl]butanamide
CID 70105715
N-(2-bromophenyl)butanamide
CID 732405
N-(2-fluorophenyl)butanamide
CID 849021
(Z)-N-(2-hydroxyphenyl)octadec-9-enamide
CID 52916764
4-(2-hydroxyanilino)-4-oxobutanoate
CID 3615801
N-[2-[3,5-bis[2-(butanoylamino)phenyl]phenyl]phenyl]butanamide
CID 102081724
3-acetamido-N-(2-hydroxyphenyl)propanamide
CID 47110153
N-(2-hydroxyphenyl)icosa-5,8,11,14-tetraenamide
CID 54249873
N-(2-hydroxyphenyl)-2-iodoacetamide
CID 66791865
N-[2-(1-hydroxyethyl)phenyl]butanamide
CID 43508507
N-[2-(2-methylpropyl)phenyl]butanamide
CID 130436413
3-(2-hydroxyanilino)-3-oxopropanoic acid
CID 69016240

Frequently Asked Questions

What is the IUPAC name of ethane;N-(2-hydroxyphenyl)butanamide?
The IUPAC name of ethane;N-(2-hydroxyphenyl)butanamide (CID 142538893) is ethane;N-(2-hydroxyphenyl)butanamide.
What is the SMILES notation for ethane;N-(2-hydroxyphenyl)butanamide?
The canonical SMILES for ethane;N-(2-hydroxyphenyl)butanamide is CC.CCCC(=O)Nc1ccccc1O.
What is the InChIKey of ethane;N-(2-hydroxyphenyl)butanamide?
The InChIKey is RHLGTAMFRWJEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2.C2H6/c1-2-5-10(13)11-8-6-3-4-7-9(8)12;1-2/h3-4,6-7,12H,2,5H2,1H3,(H,11,13);1-2H3.
What are the key properties of ethane;N-(2-hydroxyphenyl)butanamide?
ethane;N-(2-hydroxyphenyl)butanamide has a molecular weight of 209.29 g/mol, XLogP of 3.16, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(2-hydroxyphenyl)butanamide is sourced from PubChem (CID 142538893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).