2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide

C17H28N2O2 — CID 63325804

IUPAC2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide
SMILESCc1ccc(OC(C)C(=O)NCC(C)C)c(CC(C)N)c1
InChIInChI=1S/C17H28N2O2/c1-11(2)10-19-17(20)14(5)21-16-7-6-12(3)8-15(16)9-13(4)18/h6-8,11,13-14H,9-10,18H2,1-5H3,(H,19,20)
InChIKeyZGBCUOLGOIKELE-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.42
Rot. Bonds7

About 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide

2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide (PubChem CID 63325804) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide
PubChem CID63325804
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide
SMILESCc1ccc(OC(C)C(=O)NCC(C)C)c(CC(C)N)c1
InChIInChI=1S/C17H28N2O2/c1-11(2)10-19-17(20)14(5)21-16-7-6-12(3)8-15(16)9-13(4)18/h6-8,11,13-14H,9-10,18H2,1-5H3,(H,19,20)
InChIKeyZGBCUOLGOIKELE-UHFFFAOYSA-N
XLogP2.42
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide 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-aminopropyl)-4-methylphenoxy]-N-propan-2-ylpropanamide
CID 63325896
5-methyl-2-[1-(2-methylpropylamino)-1-oxopropan-2-yl]oxybenzoic acid
CID 45301849
2-[2-(2-aminobutyl)-4-methylphenoxy]-N-prop-2-ynylpropanamide
CID 63326039
2-[2-(2-aminopropyl)-4-chlorophenoxy]-N-ethylpropanamide
CID 54929160
2-[2-(2-aminobutyl)phenoxy]-N-(2-methylpropyl)propanamide
CID 60907094
2-[2-(aminomethyl)-4-fluorophenoxy]-N-(2-methylpropyl)propanamide
CID 107694652
2-[2-(2-aminopropyl)phenoxy]-N-(3-methylbutyl)propanamide
CID 60907832
2-[2-(aminomethyl)-4-methylphenoxy]-N-butylpropanamide
CID 63322427
2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide
CID 53282928
2-[2-(2-aminopropyl)phenoxy]-N-ethylpropanamide
CID 54930401
2-[2-(2-aminopropyl)-4-bromophenoxy]-N-methylpropanamide
CID 54929525
methyl 2-[4-methyl-2-[(2-methylpropylamino)methyl]phenoxy]propanoate
CID 63327028

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide?
The IUPAC name of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide (CID 63325804) is 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide?
The canonical SMILES for 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide is Cc1ccc(OC(C)C(=O)NCC(C)C)c(CC(C)N)c1.
What is the InChIKey of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide?
The InChIKey is ZGBCUOLGOIKELE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-11(2)10-19-17(20)14(5)21-16-7-6-12(3)8-15(16)9-13(4)18/h6-8,11,13-14H,9-10,18H2,1-5H3,(H,19,20).
What are the key properties of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide?
2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide has a molecular weight of 292.42 g/mol, XLogP of 2.42, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 63325804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).