N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide

C15H21NO2 — CID 78759925

IUPACN-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
SMILESCc1cc(OCC(=O)NC2CC2)ccc1C(C)C
InChIInChI=1S/C15H21NO2/c1-10(2)14-7-6-13(8-11(14)3)18-9-15(17)16-12-4-5-12/h6-8,10,12H,4-5,9H2,1-3H3,(H,16,17)
InChIKeyOGDFFAQTPGZSJA-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.78
Rot. Bonds5

About N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide

N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide (PubChem CID 78759925) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
PubChem CID78759925
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
SMILESCc1cc(OCC(=O)NC2CC2)ccc1C(C)C
InChIInChI=1S/C15H21NO2/c1-10(2)14-7-6-13(8-11(14)3)18-9-15(17)16-12-4-5-12/h6-8,10,12H,4-5,9H2,1-3H3,(H,16,17)
InChIKeyOGDFFAQTPGZSJA-UHFFFAOYSA-N
XLogP2.78
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 134007945
N-(cyclohexylcarbamothioyl)-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 19188061
N-[1-(2-hydroxybenzoyl)piperidin-4-yl]-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 51130240
N-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 55951851
N-cyclopropyl-2-[4-[2-(3-methyl-4-propan-2-ylphenoxy)acetyl]piperazin-1-yl]propanamide
CID 51299600
N-(3,4-dihydro-2H-chromen-4-yl)-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 18193059
2-[[2-(3-methyl-4-propan-2-ylphenoxy)acetyl]amino]acetic acid
CID 9170871
N-(1-hydroxypropan-2-yl)-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 78857319
2-(3-methyl-4-propan-2-ylphenoxy)-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 41099396
N-(4-hydroxycyclohexyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 78767495
N-cyclohexyl-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 94840112
2-(3,4-dimethylphenoxy)-N-piperidin-4-ylacetamide;hydrochloride
CID 119386968

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide?
The IUPAC name of N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide (CID 78759925) is N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide?
The canonical SMILES for N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide is Cc1cc(OCC(=O)NC2CC2)ccc1C(C)C.
What is the InChIKey of N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide?
The InChIKey is OGDFFAQTPGZSJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-10(2)14-7-6-13(8-11(14)3)18-9-15(17)16-12-4-5-12/h6-8,10,12H,4-5,9H2,1-3H3,(H,16,17).
What are the key properties of N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide?
N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide has a molecular weight of 247.34 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide is sourced from PubChem (CID 78759925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).