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

C17H26N2O2 — CID 115957684

IUPAC2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide
SMILESCc1cccc(CCN)c1OC(C)C(=O)NC1CCCC1
InChIInChI=1S/C17H26N2O2/c1-12-6-5-7-14(10-11-18)16(12)21-13(2)17(20)19-15-8-3-4-9-15/h5-7,13,15H,3-4,8-11,18H2,1-2H3,(H,19,20)
InChIKeyURGAFTFZKVOPCG-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.32
Rot. Bonds6

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

2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide (PubChem CID 115957684) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide
PubChem CID115957684
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide
SMILESCc1cccc(CCN)c1OC(C)C(=O)NC1CCCC1
InChIInChI=1S/C17H26N2O2/c1-12-6-5-7-14(10-11-18)16(12)21-13(2)17(20)19-15-8-3-4-9-15/h5-7,13,15H,3-4,8-11,18H2,1-2H3,(H,19,20)
InChIKeyURGAFTFZKVOPCG-UHFFFAOYSA-N
XLogP2.32
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopropylpropanamide
CID 112614872
2-[2-(2-aminoethyl)-6-ethoxyphenoxy]-N-cyclopropylpropanamide
CID 60905806
2-[2-(2-aminoethyl)-6-methoxyphenoxy]-N-cyclopropylpropanamide
CID 60904735
2-[2-(2-aminoethyl)-6-methylphenoxy]-N-tert-butylpropanamide
CID 115957613
N-cyclopropyl-2-[2-(ethylaminomethyl)-6-methylphenoxy]propanamide
CID 115952731
2-[2-(2-aminobutyl)-6-methylphenoxy]-N-cyclopropylpropanamide
CID 115958256
2-[2-(2-aminoethyl)-4-chlorophenoxy]-N-cyclopentylpropanamide
CID 60905070
2-[2-(2-aminoethyl)-4-bromophenoxy]-N-cyclopentylpropanamide
CID 60905187
2-[2-(aminomethyl)-6-methylphenoxy]-N-cyclopentylacetamide
CID 112607289
N-cycloheptyl-2-(2,3-dimethylphenoxy)propanamide
CID 46771593
(2S)-N-cyclooctyl-2-(2-methylphenoxy)propanamide
CID 94842700
2-[2-(2-aminopropyl)-6-methylphenoxy]-N-cyclopentylacetamide
CID 115958124

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide?
The IUPAC name of 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide (CID 115957684) is 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide.
What is the SMILES notation for 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide?
The canonical SMILES for 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide is Cc1cccc(CCN)c1OC(C)C(=O)NC1CCCC1.
What is the InChIKey of 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide?
The InChIKey is URGAFTFZKVOPCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-12-6-5-7-14(10-11-18)16(12)21-13(2)17(20)19-15-8-3-4-9-15/h5-7,13,15H,3-4,8-11,18H2,1-2H3,(H,19,20).
What are the key properties of 2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide?
2-[2-(2-aminoethyl)-6-methylphenoxy]-N-cyclopentylpropanamide has a molecular weight of 290.41 g/mol, XLogP of 2.32, 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-cyclopentylpropanamide is sourced from PubChem (CID 115957684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).