(2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide

C15H15FN2O2 — CID 99131304

IUPAC(2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide
SMILESCC[C@@H](Oc1ccc(F)cc1)C(=O)Nc1cccnc1
InChIInChI=1S/C15H15FN2O2/c1-2-14(20-13-7-5-11(16)6-8-13)15(19)18-12-4-3-9-17-10-12/h3-10,14H,2H2,1H3,(H,18,19)/t14-/m1/s1
InChIKeyAAABVSICORSXHS-CQSZACIVSA-N
MW274.30 g/mol
LogP3.02
Rot. Bonds5

About (2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide

(2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide (PubChem CID 99131304) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is (2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide.

Molecular Properties

Compound Name(2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide
PubChem CID99131304
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name(2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide
SMILESCC[C@@H](Oc1ccc(F)cc1)C(=O)Nc1cccnc1
InChIInChI=1S/C15H15FN2O2/c1-2-14(20-13-7-5-11(16)6-8-13)15(19)18-12-4-3-9-17-10-12/h3-10,14H,2H2,1H3,(H,18,19)/t14-/m1/s1
InChIKeyAAABVSICORSXHS-CQSZACIVSA-N
XLogP3.02
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-naphthalen-2-yloxy-N-pyridin-3-ylbutanamide
CID 92679830
2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide
CID 43876065
2-(4-fluorophenoxy)-N-(pyridin-3-ylmethyl)butanamide
CID 25252601
2-(2-methylphenoxy)-N-pyridin-3-ylbutanamide
CID 46771486
2-(4-fluorophenoxy)-N-(3-methylphenyl)butanamide
CID 53284409
(2S)-N-(3-bromophenyl)-2-(4-fluorophenoxy)butanamide
CID 92679949
(2S)-2-(4-fluorophenoxy)-N-(4-propan-2-ylphenyl)butanamide
CID 99131421
2-(4-chlorophenoxy)-N-(4-fluorophenyl)butanamide
CID 53285318
(2S)-2-(4-fluorophenoxy)-N-(3-prop-2-enoxyphenyl)butanamide
CID 28634034
(2S)-2-(4-fluorophenoxy)-N-[3-(trifluoromethyl)phenyl]butanamide
CID 28578484
(2S)-N-(3,5-dichlorophenyl)-2-(4-fluorophenoxy)butanamide
CID 94020016
(2S)-N-(3,5-difluorophenyl)-2-phenoxybutanamide
CID 7369079

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide?
The IUPAC name of (2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide (CID 99131304) is (2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide.
What is the SMILES notation for (2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide?
The canonical SMILES for (2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide is CC[C@@H](Oc1ccc(F)cc1)C(=O)Nc1cccnc1.
What is the InChIKey of (2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide?
The InChIKey is AAABVSICORSXHS-CQSZACIVSA-N. The full InChI is InChI=1S/C15H15FN2O2/c1-2-14(20-13-7-5-11(16)6-8-13)15(19)18-12-4-3-9-17-10-12/h3-10,14H,2H2,1H3,(H,18,19)/t14-/m1/s1.
What are the key properties of (2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide?
(2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide has a molecular weight of 274.30 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide is sourced from PubChem (CID 99131304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).