(3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone

C16H16O3 — CID 115813103

IUPAC(3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone
SMILESCCc1ccc(C(=O)c2cccc(OC3CC3)c2)o1
InChIInChI=1S/C16H16O3/c1-2-12-8-9-15(19-12)16(17)11-4-3-5-14(10-11)18-13-6-7-13/h3-5,8-10,13H,2,6-7H2,1H3
InChIKeyCVVIKMRHHIEIHN-UHFFFAOYSA-N
MW256.30 g/mol
LogP3.61
Rot. Bonds5

About (3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone

(3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone (PubChem CID 115813103) has the molecular formula C16H16O3 and a molecular weight of 256.30 g/mol. Its IUPAC name is (3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone.

Molecular Properties

Compound Name(3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone
PubChem CID115813103
Molecular FormulaC16H16O3
Molecular Weight256.30 g/mol
Exact Mass256.11
IUPAC Name(3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone
SMILESCCc1ccc(C(=O)c2cccc(OC3CC3)c2)o1
InChIInChI=1S/C16H16O3/c1-2-12-8-9-15(19-12)16(17)11-4-3-5-14(10-11)18-13-6-7-13/h3-5,8-10,13H,2,6-7H2,1H3
InChIKeyCVVIKMRHHIEIHN-UHFFFAOYSA-N
XLogP3.61
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone 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

(5-chlorofuran-2-yl)-(3-cyclopropyloxyphenyl)methanone
CID 106691334
[4-(aminomethyl)phenyl]-(3-cyclopropyloxyphenyl)methanone
CID 114523660
(5-ethylfuran-2-yl)-naphthalen-2-ylmethanone
CID 62344776
1-(3-cyclopropyloxyphenyl)propan-1-one
CID 114521082
[4-(2-aminoethyl)phenyl]-(3-cyclopropyloxyphenyl)methanone
CID 114523778
(3-cyclopropyloxyphenyl)-(3-ethyl-2-pyridinyl)methanone
CID 114521254
[5-(chloromethyl)furan-2-yl]-(3-methoxyphenyl)methanone
CID 82087506
[5-(aminomethyl)furan-2-yl]-(3-methoxyphenyl)methanone
CID 82082014
(3-ethoxyphenyl)-(5-methylfuran-2-yl)methanone
CID 115791255
1-(3-cyclopropyloxyphenyl)-2-methylbutan-1-one
CID 114521136
1-(3-cyclopropyloxyphenyl)-2-hydroxy-2-methylbutan-1-one
CID 103446837
5-(5-ethylfuran-2-carbonyl)-1,3-dihydrobenzimidazol-2-one
CID 79095077

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone?
The IUPAC name of (3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone (CID 115813103) is (3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone.
What is the SMILES notation for (3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone?
The canonical SMILES for (3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone is CCc1ccc(C(=O)c2cccc(OC3CC3)c2)o1.
What is the InChIKey of (3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone?
The InChIKey is CVVIKMRHHIEIHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O3/c1-2-12-8-9-15(19-12)16(17)11-4-3-5-14(10-11)18-13-6-7-13/h3-5,8-10,13H,2,6-7H2,1H3.
What are the key properties of (3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone?
(3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone has a molecular weight of 256.30 g/mol, XLogP of 3.61, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyloxyphenyl)-(5-ethylfuran-2-yl)methanone is sourced from PubChem (CID 115813103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).