2-[3-(cyclopropylmethylamino)phenoxy]acetamide

C12H16N2O2 — CID 43720269

IUPAC2-[3-(cyclopropylmethylamino)phenoxy]acetamide
SMILESNC(=O)COc1cccc(NCC2CC2)c1
InChIInChI=1S/C12H16N2O2/c13-12(15)8-16-11-3-1-2-10(6-11)14-7-9-4-5-9/h1-3,6,9,14H,4-5,7-8H2,(H2,13,15)
InChIKeyJPCVGNUAHZFWTC-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.37
Rot. Bonds6

About 2-[3-(cyclopropylmethylamino)phenoxy]acetamide

2-[3-(cyclopropylmethylamino)phenoxy]acetamide (PubChem CID 43720269) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-[3-(cyclopropylmethylamino)phenoxy]acetamide.

Molecular Properties

Compound Name2-[3-(cyclopropylmethylamino)phenoxy]acetamide
PubChem CID43720269
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name2-[3-(cyclopropylmethylamino)phenoxy]acetamide
SMILESNC(=O)COc1cccc(NCC2CC2)c1
InChIInChI=1S/C12H16N2O2/c13-12(15)8-16-11-3-1-2-10(6-11)14-7-9-4-5-9/h1-3,6,9,14H,4-5,7-8H2,(H2,13,15)
InChIKeyJPCVGNUAHZFWTC-UHFFFAOYSA-N
XLogP1.37
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(cyclohexylmethylamino)phenoxy]acetamide
CID 43720202
2-[3-[(1-methylpiperidin-3-yl)methylamino]phenoxy]acetamide
CID 62658835
methyl 2-[3-[(4-aminocyclohexyl)methylamino]phenoxy]acetate
CID 59230168
2-[3-(dicyclopropylmethylamino)phenoxy]acetamide
CID 43720251
4-amino-N-[3-(2-amino-2-oxoethoxy)phenyl]cyclohexane-1-carboxamide
CID 60849251
2-[3-(2-methylpropylamino)phenoxy]acetamide
CID 43720195
N-(cyclopropylmethyl)-3-(2-methoxyethoxy)aniline
CID 54803051
2-[3-[[5-(hydroxymethyl)furan-2-yl]methylamino]phenoxy]acetamide
CID 64579004
2-[3-(2-phenylethylamino)phenoxy]acetamide
CID 43720190
2-[3-[(4-aminocyclohexyl)methylamino]phenoxy]acetaldehyde
CID 89019369
N-[3-(2-amino-2-oxoethoxy)phenyl]-2,2-dimethylpropanamide
CID 38160075
2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide
CID 43720165

Frequently Asked Questions

What is the IUPAC name of 2-[3-(cyclopropylmethylamino)phenoxy]acetamide?
The IUPAC name of 2-[3-(cyclopropylmethylamino)phenoxy]acetamide (CID 43720269) is 2-[3-(cyclopropylmethylamino)phenoxy]acetamide.
What is the SMILES notation for 2-[3-(cyclopropylmethylamino)phenoxy]acetamide?
The canonical SMILES for 2-[3-(cyclopropylmethylamino)phenoxy]acetamide is NC(=O)COc1cccc(NCC2CC2)c1.
What is the InChIKey of 2-[3-(cyclopropylmethylamino)phenoxy]acetamide?
The InChIKey is JPCVGNUAHZFWTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c13-12(15)8-16-11-3-1-2-10(6-11)14-7-9-4-5-9/h1-3,6,9,14H,4-5,7-8H2,(H2,13,15).
What are the key properties of 2-[3-(cyclopropylmethylamino)phenoxy]acetamide?
2-[3-(cyclopropylmethylamino)phenoxy]acetamide has a molecular weight of 220.27 g/mol, XLogP of 1.37, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(cyclopropylmethylamino)phenoxy]acetamide is sourced from PubChem (CID 43720269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).