2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide

C20H23NO5 — CID 87005207

IUPAC2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide
SMILESCOc1cc(C(C)=O)ccc1OCC(=O)N(Cc1ccc(C)o1)C1CC1
InChIInChI=1S/C20H23NO5/c1-13-4-8-17(26-13)11-21(16-6-7-16)20(23)12-25-18-9-5-15(14(2)22)10-19(18)24-3/h4-5,8-10,16H,6-7,11-12H2,1-3H3
InChIKeyUUMVOLGYNIBFNM-UHFFFAOYSA-N
MW357.41 g/mol
LogP3.37
Rot. Bonds8

About 2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide

2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide (PubChem CID 87005207) has the molecular formula C20H23NO5 and a molecular weight of 357.41 g/mol. Its IUPAC name is 2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide
PubChem CID87005207
Molecular FormulaC20H23NO5
Molecular Weight357.41 g/mol
Exact Mass357.16
IUPAC Name2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide
SMILESCOc1cc(C(C)=O)ccc1OCC(=O)N(Cc1ccc(C)o1)C1CC1
InChIInChI=1S/C20H23NO5/c1-13-4-8-17(26-13)11-21(16-6-7-16)20(23)12-25-18-9-5-15(14(2)22)10-19(18)24-3/h4-5,8-10,16H,6-7,11-12H2,1-3H3
InChIKeyUUMVOLGYNIBFNM-UHFFFAOYSA-N
XLogP3.37
TPSA68.98 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-2-methoxy-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 60793853
N-cyclopropyl-2-(3-methylazetidin-3-yl)oxy-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 102655903
2-(2,4-dichlorophenoxy)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 40775858
3-chloro-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 60949956
2-(5-acetyl-2-methoxyphenyl)-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]acetamide
CID 39966518
2-(4-acetyl-2-methoxyphenoxy)-N-cyclooctylacetamide
CID 7962262
4-chloro-N-cyclopropyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]benzamide
CID 4031301
2-[[2-(4-acetyl-2-methoxyphenoxy)acetyl]-methylamino]-N-cyclopropylacetamide
CID 18093332
2-(3-acetylphenoxy)-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]acetamide
CID 18198380
N-cyclopropyl-5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pentanamide
CID 79198698
3-(4-acetylphenyl)-1-cyclopentyl-1-[(5-methylfuran-2-yl)methyl]urea
CID 151198154
N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 54872080

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide?
The IUPAC name of 2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide (CID 87005207) is 2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide.
What is the SMILES notation for 2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide?
The canonical SMILES for 2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide is COc1cc(C(C)=O)ccc1OCC(=O)N(Cc1ccc(C)o1)C1CC1.
What is the InChIKey of 2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide?
The InChIKey is UUMVOLGYNIBFNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO5/c1-13-4-8-17(26-13)11-21(16-6-7-16)20(23)12-25-18-9-5-15(14(2)22)10-19(18)24-3/h4-5,8-10,16H,6-7,11-12H2,1-3H3.
What are the key properties of 2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide?
2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide has a molecular weight of 357.41 g/mol, XLogP of 3.37, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetyl-2-methoxyphenoxy)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide is sourced from PubChem (CID 87005207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).