3-(2-aminophenoxy)-N-cyclohexylpropanamide

C15H22N2O2 — CID 54915855

IUPAC3-(2-aminophenoxy)-N-cyclohexylpropanamide
SMILESNc1ccccc1OCCC(=O)NC1CCCCC1
InChIInChI=1S/C15H22N2O2/c16-13-8-4-5-9-14(13)19-11-10-15(18)17-12-6-2-1-3-7-12/h4-5,8-9,12H,1-3,6-7,10-11,16H2,(H,17,18)
InChIKeyBCJZQVFFQNCCKT-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.49
Rot. Bonds5

About 3-(2-aminophenoxy)-N-cyclohexylpropanamide

3-(2-aminophenoxy)-N-cyclohexylpropanamide (PubChem CID 54915855) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-(2-aminophenoxy)-N-cyclohexylpropanamide.

Molecular Properties

Compound Name3-(2-aminophenoxy)-N-cyclohexylpropanamide
PubChem CID54915855
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-(2-aminophenoxy)-N-cyclohexylpropanamide
SMILESNc1ccccc1OCCC(=O)NC1CCCCC1
InChIInChI=1S/C15H22N2O2/c16-13-8-4-5-9-14(13)19-11-10-15(18)17-12-6-2-1-3-7-12/h4-5,8-9,12H,1-3,6-7,10-11,16H2,(H,17,18)
InChIKeyBCJZQVFFQNCCKT-UHFFFAOYSA-N
XLogP2.49
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.49
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-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide
CID 60737583
2-[2-[3-(cyclopropylamino)-3-oxopropoxy]phenyl]acetic acid
CID 80740402
cyclopentyl 3-(2-aminophenoxy)propanoate
CID 61310999
2-[3-(2-aminophenoxy)propyl-methylamino]-N-cyclopropylacetamide
CID 43574806
N-cyclopentyl-4-(2-ethoxyphenoxy)butanamide
CID 78781833
3-[2-amino-5-(dimethylamino)phenoxy]-N-cyclopropylpropanamide
CID 79589419
3-(2-amino-6-fluorophenoxy)-N-cyclopropylpropanamide
CID 104831210
3-(2-amino-4-cyanophenoxy)-N-cyclopropylpropanamide
CID 55098582
N-(4-aminocyclohexyl)-3-(2-phenylphenoxy)propanamide;hydrochloride
CID 119477516
2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide
CID 43572560
2-(2-aminophenoxy)-N-(cyclohexylmethyl)acetamide
CID 43371365
2-[2-(2-aminophenyl)ethoxy]-N-cycloheptylacetamide
CID 102902341

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminophenoxy)-N-cyclohexylpropanamide?
The IUPAC name of 3-(2-aminophenoxy)-N-cyclohexylpropanamide (CID 54915855) is 3-(2-aminophenoxy)-N-cyclohexylpropanamide.
What is the SMILES notation for 3-(2-aminophenoxy)-N-cyclohexylpropanamide?
The canonical SMILES for 3-(2-aminophenoxy)-N-cyclohexylpropanamide is Nc1ccccc1OCCC(=O)NC1CCCCC1.
What is the InChIKey of 3-(2-aminophenoxy)-N-cyclohexylpropanamide?
The InChIKey is BCJZQVFFQNCCKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c16-13-8-4-5-9-14(13)19-11-10-15(18)17-12-6-2-1-3-7-12/h4-5,8-9,12H,1-3,6-7,10-11,16H2,(H,17,18).
What are the key properties of 3-(2-aminophenoxy)-N-cyclohexylpropanamide?
3-(2-aminophenoxy)-N-cyclohexylpropanamide has a molecular weight of 262.35 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminophenoxy)-N-cyclohexylpropanamide is sourced from PubChem (CID 54915855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).