2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide

C14H15ClN2O3 — CID 62304320

IUPAC2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide
SMILESCC(Oc1cc(Cl)ccc1N)C(=O)NCc1ccco1
InChIInChI=1S/C14H15ClN2O3/c1-9(14(18)17-8-11-3-2-6-19-11)20-13-7-10(15)4-5-12(13)16/h2-7,9H,8,16H2,1H3,(H,17,18)
InChIKeyRTKIEGYVCGVKNF-UHFFFAOYSA-N
MW294.74 g/mol
LogP2.60
Rot. Bonds5

About 2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide

2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide (PubChem CID 62304320) has the molecular formula C14H15ClN2O3 and a molecular weight of 294.74 g/mol. Its IUPAC name is 2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide
PubChem CID62304320
Molecular FormulaC14H15ClN2O3
Molecular Weight294.74 g/mol
Exact Mass294.08
IUPAC Name2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide
SMILESCC(Oc1cc(Cl)ccc1N)C(=O)NCc1ccco1
InChIInChI=1S/C14H15ClN2O3/c1-9(14(18)17-8-11-3-2-6-19-11)20-13-7-10(15)4-5-12(13)16/h2-7,9H,8,16H2,1H3,(H,17,18)
InChIKeyRTKIEGYVCGVKNF-UHFFFAOYSA-N
XLogP2.60
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.74
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(4-bromo-2-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 2970667
2-(4-chloro-3,5-dimethylphenoxy)-N-(furan-2-ylmethyl)propanamide
CID 19191627
2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 17173386
2-[5-(aminomethyl)-2-methylphenoxy]-N-(furan-2-ylmethyl)propanamide
CID 107655743
(2S)-2-(2-acetamidophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 9116644
2-(2-amino-5-chlorophenoxy)-N-butan-2-ylpropanamide
CID 62304828
2-(3-chloro-2-cyanophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 114322470
[(2S)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 3,5-dichlorobenzoate
CID 7724166
2-(2-bromo-4-methoxyphenoxy)-N-(furan-2-ylmethyl)propanamide
CID 104707302
N-(furan-2-ylmethyl)-2-(3-methoxyphenoxy)propanamide
CID 19203901
[(2S)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 3-amino-4-chlorobenzoate
CID 30699194
N-(furan-2-ylmethyl)-2-(2-nitrophenoxy)propanamide
CID 4943832

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of 2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide (CID 62304320) is 2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for 2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for 2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide is CC(Oc1cc(Cl)ccc1N)C(=O)NCc1ccco1.
What is the InChIKey of 2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide?
The InChIKey is RTKIEGYVCGVKNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O3/c1-9(14(18)17-8-11-3-2-6-19-11)20-13-7-10(15)4-5-12(13)16/h2-7,9H,8,16H2,1H3,(H,17,18).
What are the key properties of 2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide?
2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide has a molecular weight of 294.74 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-5-chlorophenoxy)-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 62304320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).