2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide

C15H22N2O2 — CID 112607289

IUPAC2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide
SMILESCc1cccc(CN)c1OCC(=O)NC1CCCC1
InChIInChI=1S/C15H22N2O2/c1-11-5-4-6-12(9-16)15(11)19-10-14(18)17-13-7-2-3-8-13/h4-6,13H,2-3,7-10,16H2,1H3,(H,17,18)
InChIKeyZXUROAWWHAZSTN-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.89
Rot. Bonds5

About 2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide

2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide (PubChem CID 112607289) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide
PubChem CID112607289
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide
SMILESCc1cccc(CN)c1OCC(=O)NC1CCCC1
InChIInChI=1S/C15H22N2O2/c1-11-5-4-6-12(9-16)15(11)19-10-14(18)17-13-7-2-3-8-13/h4-6,13H,2-3,7-10,16H2,1H3,(H,17,18)
InChIKeyZXUROAWWHAZSTN-UHFFFAOYSA-N
XLogP1.89
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 ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-aminopropyl)-6-methylphenoxy]-N-cyclopentylacetamide
CID 115958124
2-[2-(aminomethyl)-4-bromo-6-methylphenoxy]-N-cyclopentylacetamide
CID 115960915
2-[2-(2-aminobutyl)-6-methylphenoxy]-N-cyclopropylacetamide
CID 115958175
2-(3-amino-2,6-dimethylphenoxy)-N-cyclohexylacetamide
CID 62018877
2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide
CID 115957684
2-[4-[[2-(2,6-dimethylphenoxy)acetyl]amino]piperidin-1-yl]acetamide
CID 134047526
N-[2-(aminomethyl)cyclopentyl]-2-(2,6-dimethylphenoxy)acetamide
CID 119605033
tert-butyl 4-[[2-(2,6-dimethylphenoxy)acetyl]amino]piperidine-1-carboxylate
CID 55986374
N-cycloheptyl-2-(2,4,6-trimethylphenoxy)acetamide
CID 9218083
2-[2-chloro-6-(ethylaminomethyl)phenoxy]-N-cyclopentylacetamide
CID 115952913
[2-(cyclooctylamino)-2-oxoethyl] 2-hydroxy-3-methylbenzoate
CID 2578328
2-(4-bromo-2,6-dimethylphenoxy)-N-cyclododecylacetamide
CID 19175356

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide?
The IUPAC name of 2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide (CID 112607289) is 2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide.
What is the SMILES notation for 2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide?
The canonical SMILES for 2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide is Cc1cccc(CN)c1OCC(=O)NC1CCCC1.
What is the InChIKey of 2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide?
The InChIKey is ZXUROAWWHAZSTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-5-4-6-12(9-16)15(11)19-10-14(18)17-13-7-2-3-8-13/h4-6,13H,2-3,7-10,16H2,1H3,(H,17,18).
What are the key properties of 2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide?
2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide has a molecular weight of 262.35 g/mol, XLogP of 1.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide is sourced from PubChem (CID 112607289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).