N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide

C16H24N2O2 — CID 119737329

IUPACN-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)Nc1ccccc1OC1CCCC1
InChIInChI=1S/C16H24N2O2/c1-12(11-17-2)16(19)18-14-9-5-6-10-15(14)20-13-7-3-4-8-13/h5-6,9-10,12-13,17H,3-4,7-8,11H2,1-2H3,(H,18,19)
InChIKeyMMSPIIZIRLFCIR-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.80
Rot. Bonds6

About N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide

N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide (PubChem CID 119737329) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide
PubChem CID119737329
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)Nc1ccccc1OC1CCCC1
InChIInChI=1S/C16H24N2O2/c1-12(11-17-2)16(19)18-14-9-5-6-10-15(14)20-13-7-3-4-8-13/h5-6,9-10,12-13,17H,3-4,7-8,11H2,1-2H3,(H,18,19)
InChIKeyMMSPIIZIRLFCIR-UHFFFAOYSA-N
XLogP2.80
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide
CID 119714426
2-cyclopentyloxy-N-methylaniline
CID 130903637
2-methyl-3-(methylamino)-N-(2-methylsulfanylphenyl)propanamide
CID 79196419
2-methyl-3-(methylamino)-N-(2-pyrrolidin-1-ylphenyl)propanamide
CID 79195677
3-(2-cyclohexyloxyanilino)propane-1,2-diol
CID 168596583
1-(2-cyclopentyloxyphenyl)-3-[(2S)-1-imidazol-1-ylpropan-2-yl]urea
CID 95313090
2-(4-bromophenyl)-N-(2-cyclopentyloxyphenyl)acetamide
CID 55807841
2-methyl-3-(methylamino)-N-(2-methylsulfanylphenyl)propanamide;hydrochloride
CID 119674747
(2S)-N-(2-cyclopentyloxyphenyl)-2-(1-cyclopropyltetrazol-5-yl)sulfanylpropanamide
CID 52518791
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-methyl-3-(methylamino)propanamide
CID 119859815
N-(2,4-dimethoxyphenyl)-2-methyl-3-(methylamino)propanamide
CID 79195727
2-[(2-cyclopentyloxyphenyl)methylamino]propanoic acid
CID 120913321

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide?
The IUPAC name of N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide (CID 119737329) is N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide.
What is the SMILES notation for N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide?
The canonical SMILES for N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide is CNCC(C)C(=O)Nc1ccccc1OC1CCCC1.
What is the InChIKey of N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide?
The InChIKey is MMSPIIZIRLFCIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12(11-17-2)16(19)18-14-9-5-6-10-15(14)20-13-7-3-4-8-13/h5-6,9-10,12-13,17H,3-4,7-8,11H2,1-2H3,(H,18,19).
What are the key properties of N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide?
N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide has a molecular weight of 276.38 g/mol, XLogP of 2.80, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide is sourced from PubChem (CID 119737329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).