(2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide

C15H16ClNO3 — CID 7346761

IUPAC(2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide
SMILESCC[C@@H](Oc1cccc(Cl)c1)C(=O)NCc1ccco1
InChIInChI=1S/C15H16ClNO3/c1-2-14(20-12-6-3-5-11(16)9-12)15(18)17-10-13-7-4-8-19-13/h3-9,14H,2,10H2,1H3,(H,17,18)/t14-/m1/s1
InChIKeySTTFOZXEHCOFLF-CQSZACIVSA-N
MW293.75 g/mol
LogP3.41
Rot. Bonds6

About (2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide

(2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide (PubChem CID 7346761) has the molecular formula C15H16ClNO3 and a molecular weight of 293.75 g/mol. Its IUPAC name is (2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide.

Molecular Properties

Compound Name(2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide
PubChem CID7346761
Molecular FormulaC15H16ClNO3
Molecular Weight293.75 g/mol
Exact Mass293.08
IUPAC Name(2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide
SMILESCC[C@@H](Oc1cccc(Cl)c1)C(=O)NCc1ccco1
InChIInChI=1S/C15H16ClNO3/c1-2-14(20-12-6-3-5-11(16)9-12)15(18)17-10-13-7-4-8-19-13/h3-9,14H,2,10H2,1H3,(H,17,18)/t14-/m1/s1
InChIKeySTTFOZXEHCOFLF-CQSZACIVSA-N
XLogP3.41
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.75
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(3-chlorophenoxy)-N-ethylbutanamide
CID 99131342
N-benzyl-2-(3-chlorophenoxy)butanamide
CID 13232174
2-(3-chlorophenoxy)-N-(thiophen-2-ylmethyl)butanamide
CID 2970792
2-(3-chlorophenoxy)-N-[(2-fluorophenyl)methyl]butanamide
CID 17068388
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(furan-2-ylmethyl)butanamide
CID 45148077
N-(furan-2-ylmethyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butanamide
CID 133231084
N-[(3-chlorophenyl)methyl]-2-phenoxybutanamide
CID 13232131
(2R)-N-[(3-chlorophenyl)methyl]-2-phenoxybutanamide
CID 8891222
2-(3-chlorophenoxy)-N-(naphthalen-2-ylmethyl)butanamide
CID 133218838
(2S)-2-(3-chlorophenoxy)-N-[(2,5-diethylphenyl)methyl]butanamide
CID 100743652
(2S)-2-(3-chlorophenoxy)-N-(pyridin-2-ylmethyl)butanamide
CID 29057267
2-(4-chlorophenoxy)-N-[3-(furan-2-yl)propyl]butanamide
CID 53285212

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide?
The IUPAC name of (2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide (CID 7346761) is (2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide.
What is the SMILES notation for (2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide?
The canonical SMILES for (2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide is CC[C@@H](Oc1cccc(Cl)c1)C(=O)NCc1ccco1.
What is the InChIKey of (2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide?
The InChIKey is STTFOZXEHCOFLF-CQSZACIVSA-N. The full InChI is InChI=1S/C15H16ClNO3/c1-2-14(20-12-6-3-5-11(16)9-12)15(18)17-10-13-7-4-8-19-13/h3-9,14H,2,10H2,1H3,(H,17,18)/t14-/m1/s1.
What are the key properties of (2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide?
(2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide has a molecular weight of 293.75 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-chlorophenoxy)-N-(furan-2-ylmethyl)butanamide is sourced from PubChem (CID 7346761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).