N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide

C13H17NO2 — CID 4113350

IUPACN-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide
SMILESCc1ccc(C)c(OCC(=O)NC2CC2)c1
InChIInChI=1S/C13H17NO2/c1-9-3-4-10(2)12(7-9)16-8-13(15)14-11-5-6-11/h3-4,7,11H,5-6,8H2,1-2H3,(H,14,15)
InChIKeyDDMMZEACAGQDQX-UHFFFAOYSA-N
MW219.28 g/mol
LogP1.96
Rot. Bonds4

About N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide

N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide (PubChem CID 4113350) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide
PubChem CID4113350
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC NameN-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide
SMILESCc1ccc(C)c(OCC(=O)NC2CC2)c1
InChIInChI=1S/C13H17NO2/c1-9-3-4-10(2)12(7-9)16-8-13(15)14-11-5-6-11/h3-4,7,11H,5-6,8H2,1-2H3,(H,14,15)
InChIKeyDDMMZEACAGQDQX-UHFFFAOYSA-N
XLogP1.96
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-bromo-2-methylphenoxy)-N-cyclopropylacetamide
CID 107284188
2-(2,5-dimethylphenoxy)-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119452617
2-(2,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)acetamide
CID 16544779
2-(5-carbamothioyl-2-methylphenoxy)-N-cyclopropylacetamide
CID 107656439
N-(4-aminocyclohexyl)-2-(2,4-dimethylphenoxy)acetamide
CID 119477487
N-cyclopropyl-2-[2-(hydroxymethyl)-4-methylphenoxy]acetamide
CID 63325684
N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide
CID 24581450
2-(2,5-dimethylphenoxy)-N-[1-(2-ethylbutanoyl)piperidin-4-yl]acetamide
CID 55949493
N'-(2-chloroacetyl)-2-(2,5-dimethylphenoxy)acetohydrazide
CID 166414788
N-cyclopropyl-2-[5-methyl-2-[1-(methylamino)ethyl]phenoxy]acetamide
CID 63639605
N-[2-(aminomethyl)cyclohexyl]-2-(2,5-dimethylphenoxy)acetamide
CID 119611347
2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide
CID 63326335

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide?
The IUPAC name of N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide (CID 4113350) is N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide is Cc1ccc(C)c(OCC(=O)NC2CC2)c1.
What is the InChIKey of N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide?
The InChIKey is DDMMZEACAGQDQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-9-3-4-10(2)12(7-9)16-8-13(15)14-11-5-6-11/h3-4,7,11H,5-6,8H2,1-2H3,(H,14,15).
What are the key properties of N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide?
N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide has a molecular weight of 219.28 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide is sourced from PubChem (CID 4113350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).