N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide

C16H23NO2 — CID 60737583

IUPACN-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide
SMILESCc1cccc(OCCC(=O)NC2CCCC2)c1C
InChIInChI=1S/C16H23NO2/c1-12-6-5-9-15(13(12)2)19-11-10-16(18)17-14-7-3-4-8-14/h5-6,9,14H,3-4,7-8,10-11H2,1-2H3,(H,17,18)
InChIKeyUCCFDJPPDYPHQW-UHFFFAOYSA-N
MW261.37 g/mol
LogP3.13
Rot. Bonds5

About N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide

N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide (PubChem CID 60737583) has the molecular formula C16H23NO2 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide
PubChem CID60737583
Molecular FormulaC16H23NO2
Molecular Weight261.37 g/mol
Exact Mass261.17
IUPAC NameN-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide
SMILESCc1cccc(OCCC(=O)NC2CCCC2)c1C
InChIInChI=1S/C16H23NO2/c1-12-6-5-9-15(13(12)2)19-11-10-16(18)17-14-7-3-4-8-14/h5-6,9,14H,3-4,7-8,10-11H2,1-2H3,(H,17,18)
InChIKeyUCCFDJPPDYPHQW-UHFFFAOYSA-N
XLogP3.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,3-dimethylphenoxy)-N-(4-hydroxycyclohexyl)propanamide
CID 43417399
N-(4-aminocyclohexyl)-3-(2,3-dimethylphenoxy)propanamide;hydrochloride
CID 119478904
3-(2,3-dimethylphenoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119454143
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-(2,3-dimethylphenoxy)propanamide
CID 86985236
2-(2,3-dimethylphenoxy)-N-(4-hydroxycyclohexyl)acetamide
CID 43389110
N-cyclopropyl-2-[4-[3-(2,3-dimethylphenoxy)propanoyl]piperazin-1-yl]acetamide
CID 47024315
3-(2-aminophenoxy)-N-cyclohexylpropanamide
CID 54915855
N-cyclopentyl-4-(2-ethoxyphenoxy)butanamide
CID 78781833
3-(2,3-dimethylphenoxy)-N-(2-methoxyethoxy)propanamide
CID 79675927
(2R)-N-cyclopentyl-2-(2,3-dimethylphenoxy)butanamide
CID 92677449
[2-(cyclopentylcarbamoylamino)-2-oxoethyl] 3-(2-methylphenoxy)propanoate
CID 9139997
N-(cyclopentylmethyl)-2-(2,3-dimethylphenoxy)ethanamine
CID 62572121

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide?
The IUPAC name of N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide (CID 60737583) is N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide.
What is the SMILES notation for N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide?
The canonical SMILES for N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide is Cc1cccc(OCCC(=O)NC2CCCC2)c1C.
What is the InChIKey of N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide?
The InChIKey is UCCFDJPPDYPHQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-12-6-5-9-15(13(12)2)19-11-10-16(18)17-14-7-3-4-8-14/h5-6,9,14H,3-4,7-8,10-11H2,1-2H3,(H,17,18).
What are the key properties of N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide?
N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide has a molecular weight of 261.37 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide is sourced from PubChem (CID 60737583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).