2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide

C14H20FNO3 — CID 115968801

IUPAC2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide
SMILESCC(Oc1ccc(F)cc1)C(=O)NC(C)(C)CCO
InChIInChI=1S/C14H20FNO3/c1-10(13(18)16-14(2,3)8-9-17)19-12-6-4-11(15)5-7-12/h4-7,10,17H,8-9H2,1-3H3,(H,16,18)
InChIKeyCAWMVJQNXRDDNQ-UHFFFAOYSA-N
MW269.32 g/mol
LogP1.87
Rot. Bonds6

About 2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide

2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide (PubChem CID 115968801) has the molecular formula C14H20FNO3 and a molecular weight of 269.32 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide
PubChem CID115968801
Molecular FormulaC14H20FNO3
Molecular Weight269.32 g/mol
Exact Mass269.14
IUPAC Name2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide
SMILESCC(Oc1ccc(F)cc1)C(=O)NC(C)(C)CCO
InChIInChI=1S/C14H20FNO3/c1-10(13(18)16-14(2,3)8-9-17)19-12-6-4-11(15)5-7-12/h4-7,10,17H,8-9H2,1-3H3,(H,16,18)
InChIKeyCAWMVJQNXRDDNQ-UHFFFAOYSA-N
XLogP1.87
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.32
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-hydroxy-2-methylbutan-2-yl)-2-(4-methoxyphenoxy)propanamide
CID 115968798
2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
CID 43391422
4-methyl-4-[2-(4-methylsulfanylphenoxy)propanoylamino]pentanoic acid
CID 119204413
(2R)-2-(4-fluorophenoxy)-N-propan-2-ylpropanamide
CID 94335659
N'-[2-(4-fluorophenoxy)propanoyl]-3,3-dimethylbutanehydrazide
CID 46656768
2-(4-fluorophenoxy)-N-propylpropanamide
CID 21366860
2-(4-fluorophenoxy)-N-pentan-3-ylpropanamide
CID 53282042
2-(4-tert-butylphenoxy)-N-(4-fluorophenyl)propanamide
CID 2938601
(2R)-2-[2-(4-fluorophenoxy)propanoylamino]-3,3-dimethylbutanoic acid
CID 103926629
2-(4-fluorophenoxy)-N-(2-hydroxy-4-methoxy-2-methylbutyl)propanamide
CID 103712364
(2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide
CID 42091432
2-[4-(difluoromethoxy)phenyl]-N-(4-hydroxy-2-methylbutan-2-yl)acetamide
CID 115870205

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide (CID 115968801) is 2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide is CC(Oc1ccc(F)cc1)C(=O)NC(C)(C)CCO.
What is the InChIKey of 2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide?
The InChIKey is CAWMVJQNXRDDNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO3/c1-10(13(18)16-14(2,3)8-9-17)19-12-6-4-11(15)5-7-12/h4-7,10,17H,8-9H2,1-3H3,(H,16,18).
What are the key properties of 2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide?
2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide has a molecular weight of 269.32 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)propanamide is sourced from PubChem (CID 115968801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).