2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide

C19H22FNO3 — CID 43876065

IUPAC2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide
SMILESCCC(Oc1ccc(F)cc1)C(=O)Nc1cccc(OC(C)C)c1
InChIInChI=1S/C19H22FNO3/c1-4-18(24-16-10-8-14(20)9-11-16)19(22)21-15-6-5-7-17(12-15)23-13(2)3/h5-13,18H,4H2,1-3H3,(H,21,22)
InChIKeyBGEBUKOAKGKGRK-UHFFFAOYSA-N
MW331.39 g/mol
LogP4.41
Rot. Bonds7

About 2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide

2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide (PubChem CID 43876065) has the molecular formula C19H22FNO3 and a molecular weight of 331.39 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide
PubChem CID43876065
Molecular FormulaC19H22FNO3
Molecular Weight331.39 g/mol
Exact Mass331.16
IUPAC Name2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide
SMILESCCC(Oc1ccc(F)cc1)C(=O)Nc1cccc(OC(C)C)c1
InChIInChI=1S/C19H22FNO3/c1-4-18(24-16-10-8-14(20)9-11-16)19(22)21-15-6-5-7-17(12-15)23-13(2)3/h5-13,18H,4H2,1-3H3,(H,21,22)
InChIKeyBGEBUKOAKGKGRK-UHFFFAOYSA-N
XLogP4.41
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.39
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenoxy-N-(3-propan-2-yloxyphenyl)butanamide
CID 17154738
2-(4-fluorophenoxy)-N-(3-methylphenyl)butanamide
CID 53284409
(2S)-N-(3-bromophenyl)-2-(4-fluorophenoxy)butanamide
CID 92679949
2-(3,4-dimethylphenoxy)-N-(3-propan-2-yloxyphenyl)butanamide
CID 43905698
(2S)-2-(4-fluorophenoxy)-N-(3-prop-2-enoxyphenyl)butanamide
CID 28634034
(2S)-2-(4-fluorophenoxy)-N-[3-(trifluoromethyl)phenyl]butanamide
CID 28578484
2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)butanamide
CID 132654423
(2S)-2-(4-fluorophenoxy)-N-(3-nitrophenyl)butanamide
CID 92682200
N-(3-propan-2-yloxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butanamide
CID 133199833
(2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide
CID 99131304
[3-(2-phenoxybutanoylamino)phenyl] acetate
CID 17341786
(2S)-2-(4-fluorophenoxy)-N-(4-propan-2-ylphenyl)butanamide
CID 99131421

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide (CID 43876065) is 2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide is CCC(Oc1ccc(F)cc1)C(=O)Nc1cccc(OC(C)C)c1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide?
The InChIKey is BGEBUKOAKGKGRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO3/c1-4-18(24-16-10-8-14(20)9-11-16)19(22)21-15-6-5-7-17(12-15)23-13(2)3/h5-13,18H,4H2,1-3H3,(H,21,22).
What are the key properties of 2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide?
2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide has a molecular weight of 331.39 g/mol, XLogP of 4.41, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide is sourced from PubChem (CID 43876065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).