2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide

C14H18N2O4 — CID 9296003

IUPAC2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide
SMILESC/C=C/c1ccc(OCC(=O)NCC(N)=O)c(OC)c1
InChIInChI=1S/C14H18N2O4/c1-3-4-10-5-6-11(12(7-10)19-2)20-9-14(18)16-8-13(15)17/h3-7H,8-9H2,1-2H3,(H2,15,17)(H,16,18)/b4-3+
InChIKeyFQXJWXCXTNBJOU-ONEGZZNKSA-N
MW278.31 g/mol
LogP0.71
Rot. Bonds7

About 2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide

2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide (PubChem CID 9296003) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide.

Molecular Properties

Compound Name2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide
PubChem CID9296003
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide
SMILESC/C=C/c1ccc(OCC(=O)NCC(N)=O)c(OC)c1
InChIInChI=1S/C14H18N2O4/c1-3-4-10-5-6-11(12(7-10)19-2)20-9-14(18)16-8-13(15)17/h3-7H,8-9H2,1-2H3,(H2,15,17)(H,16,18)/b4-3+
InChIKeyFQXJWXCXTNBJOU-ONEGZZNKSA-N
XLogP0.71
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]acetamide
CID 60666680
N-[2-(4-fluorophenyl)ethyl]-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 7478784
N-[(2R)-2-(ethylamino)propyl]-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide;hydrochloride
CID 120650568
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide
CID 112792814
N-cyclopropyl-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 7973430
3-[4-[[2-(2-methoxy-4-prop-1-enylphenoxy)acetyl]amino]phenoxy]propanamide
CID 55727070
N-(1-hydroxypropan-2-yl)-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 78857545
N-(3,5-dimethoxyphenyl)-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 7772741
3-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]-2-methyl-2-phenylpropanoic acid
CID 120700681
methyl N-[4-[[[2-(2-methoxy-4-prop-1-enylphenoxy)acetyl]amino]methyl]phenyl]carbamate
CID 55732069
1-(2-methoxy-4-prop-1-enylphenoxy)butan-2-one
CID 76931733
2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-N-(2,4,6-trimethylphenyl)acetamide
CID 7695867

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide?
The IUPAC name of 2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide (CID 9296003) is 2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide.
What is the SMILES notation for 2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide?
The canonical SMILES for 2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide is C/C=C/c1ccc(OCC(=O)NCC(N)=O)c(OC)c1.
What is the InChIKey of 2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide?
The InChIKey is FQXJWXCXTNBJOU-ONEGZZNKSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-3-4-10-5-6-11(12(7-10)19-2)20-9-14(18)16-8-13(15)17/h3-7H,8-9H2,1-2H3,(H2,15,17)(H,16,18)/b4-3+.
What are the key properties of 2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide?
2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide has a molecular weight of 278.31 g/mol, XLogP of 0.71, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]acetamide is sourced from PubChem (CID 9296003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).