2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide

C15H22N2O2 — CID 43437833

IUPAC2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide
SMILESCc1c(N)cccc1OC(C)C(=O)NC1CCCC1
InChIInChI=1S/C15H22N2O2/c1-10-13(16)8-5-9-14(10)19-11(2)15(18)17-12-6-3-4-7-12/h5,8-9,11-12H,3-4,6-7,16H2,1-2H3,(H,17,18)
InChIKeyPOXDAFRIHHTVIA-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.40
Rot. Bonds4

About 2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide

2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide (PubChem CID 43437833) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide
PubChem CID43437833
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide
SMILESCc1c(N)cccc1OC(C)C(=O)NC1CCCC1
InChIInChI=1S/C15H22N2O2/c1-10-13(16)8-5-9-14(10)19-11(2)15(18)17-12-6-3-4-7-12/h5,8-9,11-12H,3-4,6-7,16H2,1-2H3,(H,17,18)
InChIKeyPOXDAFRIHHTVIA-UHFFFAOYSA-N
XLogP2.40
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-cycloheptyl-2-(2,3-dimethylphenoxy)propanamide
CID 46771593
(2R)-N-cyclopropyl-2-(2,3-dimethylphenoxy)propanamide
CID 39717598
2-(3-amino-2-bromophenoxy)-N-cyclopropylpropanamide
CID 113497736
(2S)-N-cyclooctyl-2-(2-methylphenoxy)propanamide
CID 94842700
(2S)-N-cyclopentyl-2-(2-methoxyphenoxy)propanamide
CID 42082135
2-(2-amino-4-fluorophenoxy)-N-cyclopentylpropanamide
CID 62367828
N-cyclohexyl-2-(2-methoxyphenoxy)propanamide
CID 5003306
(2S)-N-cycloheptyl-2-(2-ethylphenoxy)propanamide
CID 93488429
N-cycloheptyl-2-(2-propan-2-ylphenoxy)propanamide
CID 43904274
(2R)-2-(2-acetamidophenoxy)-N-cyclohexylpropanamide
CID 9111099
2-(2-acetylphenoxy)-N-cyclohexylpropanamide
CID 43083117
N-cyclooctyl-2-(3-methylphenoxy)propanamide
CID 2976571

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide?
The IUPAC name of 2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide (CID 43437833) is 2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide.
What is the SMILES notation for 2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide?
The canonical SMILES for 2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide is Cc1c(N)cccc1OC(C)C(=O)NC1CCCC1.
What is the InChIKey of 2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide?
The InChIKey is POXDAFRIHHTVIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-13(16)8-5-9-14(10)19-11(2)15(18)17-12-6-3-4-7-12/h5,8-9,11-12H,3-4,6-7,16H2,1-2H3,(H,17,18).
What are the key properties of 2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide?
2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide has a molecular weight of 262.35 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide is sourced from PubChem (CID 43437833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).