1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid

C19H19NO5 — CID 84559632

IUPAC1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid
SMILESCOc1ccccc1OCC(=O)NC1(C(=O)O)CC1c1ccccc1
InChIInChI=1S/C19H19NO5/c1-24-15-9-5-6-10-16(15)25-12-17(21)20-19(18(22)23)11-14(19)13-7-3-2-4-8-13/h2-10,14H,11-12H2,1H3,(H,20,21)(H,22,23)
InChIKeyMKXBCQHVBXKBBA-UHFFFAOYSA-N
MW341.36 g/mol
LogP2.20
Rot. Bonds7

About 1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid

1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid (PubChem CID 84559632) has the molecular formula C19H19NO5 and a molecular weight of 341.36 g/mol. Its IUPAC name is 1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid.

Molecular Properties

Compound Name1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid
PubChem CID84559632
Molecular FormulaC19H19NO5
Molecular Weight341.36 g/mol
Exact Mass341.13
IUPAC Name1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid
SMILESCOc1ccccc1OCC(=O)NC1(C(=O)O)CC1c1ccccc1
InChIInChI=1S/C19H19NO5/c1-24-15-9-5-6-10-16(15)25-12-17(21)20-19(18(22)23)11-14(19)13-7-3-2-4-8-13/h2-10,14H,11-12H2,1H3,(H,20,21)(H,22,23)
InChIKeyMKXBCQHVBXKBBA-UHFFFAOYSA-N
XLogP2.20
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.36
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-(4-methoxyphenoxy)butanoylamino]-2-phenylcyclopropane-1-carboxylic acid
CID 84559138
N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide
CID 115878022
2-(2-methoxyphenoxy)-N-(oxiran-2-ylmethyl)acetamide
CID 102548369
1-[[2-(2-hydroxyphenoxy)acetyl]amino]cyclopropane-1-carboxylic acid
CID 65452796
trans-(1S,2R)-1-[[(2S)-2-hydroxypropanoyl]amino]-2-phenylcyclopropane-1-carboxylic acid
CID 176961744
N-tert-butyl-2-(2-methoxyphenoxy)acetamide
CID 922262
(2S)-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanoic acid
CID 746811
2-(2-methoxyphenoxy)-N-[(Z)-[(5R)-3,3,5-trimethylcyclohexylidene]amino]acetamide
CID 7689241
N-(cyclohexylmethyl)-2-(2-methoxyphenoxy)acetamide
CID 2083257
2-(4-chloro-2-methylphenoxy)-N'-[2-(2-methoxyphenoxy)acetyl]acetohydrazide
CID 2545386
2-(2-methoxyphenoxy)-N-piperidin-4-ylacetamide
CID 28810945
2-(2-methoxyphenoxy)-N-[(1-phenylcyclopentyl)methyl]acetamide
CID 18128274

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid?
The IUPAC name of 1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid (CID 84559632) is 1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid.
What is the SMILES notation for 1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid?
The canonical SMILES for 1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid is COc1ccccc1OCC(=O)NC1(C(=O)O)CC1c1ccccc1.
What is the InChIKey of 1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid?
The InChIKey is MKXBCQHVBXKBBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO5/c1-24-15-9-5-6-10-16(15)25-12-17(21)20-19(18(22)23)11-14(19)13-7-3-2-4-8-13/h2-10,14H,11-12H2,1H3,(H,20,21)(H,22,23).
What are the key properties of 1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid?
1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid has a molecular weight of 341.36 g/mol, XLogP of 2.20, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(2-methoxyphenoxy)acetyl]amino]-2-phenylcyclopropane-1-carboxylic acid is sourced from PubChem (CID 84559632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).