2-(4-chlorophenyl)-5-propylfuran

C13H13ClO — CID 91550346

IUPAC2-(4-chlorophenyl)-5-propylfuran
SMILESCCCc1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C13H13ClO/c1-2-3-12-8-9-13(15-12)10-4-6-11(14)7-5-10/h4-9H,2-3H2,1H3
InChIKeyAQKIKNGRFNTCEO-UHFFFAOYSA-N
MW220.70 g/mol
LogP4.55
Rot. Bonds3

About 2-(4-chlorophenyl)-5-propylfuran

2-(4-chlorophenyl)-5-propylfuran (PubChem CID 91550346) has the molecular formula C13H13ClO and a molecular weight of 220.70 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5-propylfuran.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5-propylfuran
PubChem CID91550346
Molecular FormulaC13H13ClO
Molecular Weight220.70 g/mol
Exact Mass220.07
IUPAC Name2-(4-chlorophenyl)-5-propylfuran
SMILESCCCc1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C13H13ClO/c1-2-3-12-8-9-13(15-12)10-4-6-11(14)7-5-10/h4-9H,2-3H2,1H3
InChIKeyAQKIKNGRFNTCEO-UHFFFAOYSA-N
XLogP4.55
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.70
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[5-(4-chlorophenyl)furan-2-yl]propan-1-ol
CID 170887546
1-[5-(4-chlorophenyl)furan-2-yl]-N,N-dimethylmethanamine;hydrochloride
CID 131862742
N,N-bis[[5-(4-chlorophenyl)furan-2-yl]methyl]pentan-1-amine
CID 21413431
2-butyl-5-(4-methylphenyl)furan
CID 86258788
2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]butan-1-ol
CID 4723603
2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]acetonitrile;hydrochloride
CID 17332098
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-N-methylprop-2-yn-1-amine
CID 21388068
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-2-methylaniline
CID 91674302
3-[[5-(4-chlorophenyl)furan-2-yl]methoxy]propan-1-amine
CID 112519724
1-[(Z)-[5-(4-chlorophenyl)furan-2-yl]methylideneamino]-3-ethylthiourea
CID 94829795
2-[4-[2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-oxoethyl]piperazin-1-yl]-N-propylacetamide
CID 55381607
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-2,4-dimethylaniline
CID 91674289

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5-propylfuran?
The IUPAC name of 2-(4-chlorophenyl)-5-propylfuran (CID 91550346) is 2-(4-chlorophenyl)-5-propylfuran.
What is the SMILES notation for 2-(4-chlorophenyl)-5-propylfuran?
The canonical SMILES for 2-(4-chlorophenyl)-5-propylfuran is CCCc1ccc(-c2ccc(Cl)cc2)o1.
What is the InChIKey of 2-(4-chlorophenyl)-5-propylfuran?
The InChIKey is AQKIKNGRFNTCEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClO/c1-2-3-12-8-9-13(15-12)10-4-6-11(14)7-5-10/h4-9H,2-3H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-5-propylfuran?
2-(4-chlorophenyl)-5-propylfuran has a molecular weight of 220.70 g/mol, XLogP of 4.55, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5-propylfuran is sourced from PubChem (CID 91550346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).