2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide

C15H22N2O2 — CID 112614872

IUPAC2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide
SMILESCc1cccc(CCN)c1OC(C)C(=O)NC1CC1
InChIInChI=1S/C15H22N2O2/c1-10-4-3-5-12(8-9-16)14(10)19-11(2)15(18)17-13-6-7-13/h3-5,11,13H,6-9,16H2,1-2H3,(H,17,18)
InChIKeyIVYMNFQMVBQGKX-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.54
Rot. Bonds6

About 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide

2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide (PubChem CID 112614872) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide.

Molecular Properties

Compound Name2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide
PubChem CID112614872
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide
SMILESCc1cccc(CCN)c1OC(C)C(=O)NC1CC1
InChIInChI=1S/C15H22N2O2/c1-10-4-3-5-12(8-9-16)14(10)19-11(2)15(18)17-13-6-7-13/h3-5,11,13H,6-9,16H2,1-2H3,(H,17,18)
InChIKeyIVYMNFQMVBQGKX-UHFFFAOYSA-N
XLogP1.54
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide
CID 115957684
2-[2-(2-aminoethyl)-6-methoxyphenoxy]-N-cyclopropylpropanamide
CID 60904735
2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-cyclopropylpropanamide
CID 60905806
N-cyclopropyl-2-[2-(ethylaminomethyl)-6-methylphenoxy]propanamide
CID 115952731
2-[2-(2-aminobutyl)-6-methylphenoxy]-N-cyclopropylpropanamide
CID 115958256
2-[2-(2-aminoethyl)-6-methylphenoxy]-N-tert-butylpropanamide
CID 115957613
(2R)-N-cyclopropyl-2-(2,3-dimethylphenoxy)propanamide
CID 39717598
ethyl 2-[2-(2-aminoethyl)-6-methylphenoxy]butanoate
CID 112614882
2-[2-(aminomethyl)-6-methylphenoxy]-N-(2-methylpropyl)propanamide
CID 112607249
2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-methylpropanamide
CID 54930374
2-[2-(2-aminoethyl)-6-methylphenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 115957680
2-[2-(2-aminoethyl)-4-chlorophenoxy]-N-cyclopentylpropanamide
CID 60905070

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide?
The IUPAC name of 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide (CID 112614872) is 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide.
What is the SMILES notation for 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide?
The canonical SMILES for 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide is Cc1cccc(CCN)c1OC(C)C(=O)NC1CC1.
What is the InChIKey of 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide?
The InChIKey is IVYMNFQMVBQGKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-4-3-5-12(8-9-16)14(10)19-11(2)15(18)17-13-6-7-13/h3-5,11,13H,6-9,16H2,1-2H3,(H,17,18).
What are the key properties of 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide?
2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide has a molecular weight of 262.35 g/mol, XLogP of 1.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide is sourced from PubChem (CID 112614872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).