N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide

C16H22N2O3 — CID 46446393

IUPACN-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide
SMILESCC(C)c1cccc(OCC(=O)NCC(=O)NC2CC2)c1
InChIInChI=1S/C16H22N2O3/c1-11(2)12-4-3-5-14(8-12)21-10-16(20)17-9-15(19)18-13-6-7-13/h3-5,8,11,13H,6-7,9-10H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyLEFSMOAHQDGFFR-UHFFFAOYSA-N
MW290.36 g/mol
LogP1.58
Rot. Bonds7

About N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide

N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide (PubChem CID 46446393) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide
PubChem CID46446393
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC NameN-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide
SMILESCC(C)c1cccc(OCC(=O)NCC(=O)NC2CC2)c1
InChIInChI=1S/C16H22N2O3/c1-11(2)12-4-3-5-14(8-12)21-10-16(20)17-9-15(19)18-13-6-7-13/h3-5,8,11,13H,6-7,9-10H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyLEFSMOAHQDGFFR-UHFFFAOYSA-N
XLogP1.58
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(1-aminoethyl)phenoxy]-N-cyclopropylacetamide
CID 16783350
ethyl 2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetate
CID 60812030
2-(3-propan-2-ylphenoxy)-N-propylacetamide
CID 60624182
N-cyclooctyl-2-[(2-phenoxyacetyl)amino]acetamide
CID 24635122
N-(4-aminocyclohexyl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride
CID 119477453
methyl 2-[[[2-(3-propan-2-ylphenoxy)acetyl]amino]methyl]cyclohexane-1-carboxylate
CID 108745280
methyl 2-hydroxy-3-[[2-(3-propan-2-ylphenoxy)acetyl]amino]propanoate
CID 103957835
N-cyclopropyl-3-[3-(1-hydroxyethyl)phenoxy]propanamide
CID 62627215
N',N'-dimethyl-2-(3-propan-2-ylphenoxy)acetohydrazide
CID 116820828
3-[3-[(1S)-1-aminoethyl]phenoxy]-N-cyclopropylpropanamide
CID 63367378
N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-(3-propan-2-ylphenoxy)acetamide
CID 114630480
N-(3-methylpiperidin-4-yl)-2-(3-propan-2-ylphenoxy)acetamide
CID 120556407

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide?
The IUPAC name of N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide (CID 46446393) is N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide is CC(C)c1cccc(OCC(=O)NCC(=O)NC2CC2)c1.
What is the InChIKey of N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide?
The InChIKey is LEFSMOAHQDGFFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-11(2)12-4-3-5-14(8-12)21-10-16(20)17-9-15(19)18-13-6-7-13/h3-5,8,11,13H,6-7,9-10H2,1-2H3,(H,17,20)(H,18,19).
What are the key properties of N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide?
N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide has a molecular weight of 290.36 g/mol, XLogP of 1.58, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[2-(3-propan-2-ylphenoxy)acetyl]amino]acetamide is sourced from PubChem (CID 46446393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).