(4-chloronaphthalen-1-yl)-(furan-2-yl)methanone

C15H9ClO2 — CID 79601314

IUPAC(4-chloronaphthalen-1-yl)-(furan-2-yl)methanone
SMILESO=C(c1ccco1)c1ccc(Cl)c2ccccc12
InChIInChI=1S/C15H9ClO2/c16-13-8-7-12(10-4-1-2-5-11(10)13)15(17)14-6-3-9-18-14/h1-9H
InChIKeyMNLLLHMQIRNXEZ-UHFFFAOYSA-N
MW256.69 g/mol
LogP4.32
Rot. Bonds2

About (4-chloronaphthalen-1-yl)-(furan-2-yl)methanone

(4-chloronaphthalen-1-yl)-(furan-2-yl)methanone (PubChem CID 79601314) has the molecular formula C15H9ClO2 and a molecular weight of 256.69 g/mol. Its IUPAC name is (4-chloronaphthalen-1-yl)-(furan-2-yl)methanone.

Molecular Properties

Compound Name(4-chloronaphthalen-1-yl)-(furan-2-yl)methanone
PubChem CID79601314
Molecular FormulaC15H9ClO2
Molecular Weight256.69 g/mol
Exact Mass256.03
IUPAC Name(4-chloronaphthalen-1-yl)-(furan-2-yl)methanone
SMILESO=C(c1ccco1)c1ccc(Cl)c2ccccc12
InChIInChI=1S/C15H9ClO2/c16-13-8-7-12(10-4-1-2-5-11(10)13)15(17)14-6-3-9-18-14/h1-9H
InChIKeyMNLLLHMQIRNXEZ-UHFFFAOYSA-N
XLogP4.32
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.69
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-chloronaphthalen-1-yl)-(5-nitrofuran-2-yl)methanone
CID 79591372
(4-chloro-3-methylphenyl)-(furan-2-yl)methanone
CID 91636318
(2-chloro-4-methoxyphenyl)-(furan-2-yl)methanone
CID 21430685
(4-amino-3,5-dichlorophenyl)-(furan-2-yl)methanone
CID 116609945
(2-chloro-4-nitrophenyl)-(furan-2-yl)methanone
CID 18967626
(2-chloro-4-fluorophenyl)-(4-chloronaphthalen-1-yl)methanone
CID 79591394
[1-[(4-chlorophenyl)methyl]indol-3-yl]-(furan-2-yl)methanone
CID 955150
(4-chloronaphthalen-1-yl)-(2,4-dimethylphenyl)methanone
CID 79591122
(5-chloro-2-methylphenyl)-(furan-2-yl)methanone
CID 82883432
1-(4-chloronaphthalen-1-yl)-2,2-dimethylpropan-1-one
CID 79601820
1-(4-chloronaphthalen-1-yl)-2,2-difluoroethanone
CID 103513654
(3-chloro-4-methylphenyl)-(4-chloronaphthalen-1-yl)methanone
CID 79591374

Frequently Asked Questions

What is the IUPAC name of (4-chloronaphthalen-1-yl)-(furan-2-yl)methanone?
The IUPAC name of (4-chloronaphthalen-1-yl)-(furan-2-yl)methanone (CID 79601314) is (4-chloronaphthalen-1-yl)-(furan-2-yl)methanone.
What is the SMILES notation for (4-chloronaphthalen-1-yl)-(furan-2-yl)methanone?
The canonical SMILES for (4-chloronaphthalen-1-yl)-(furan-2-yl)methanone is O=C(c1ccco1)c1ccc(Cl)c2ccccc12.
What is the InChIKey of (4-chloronaphthalen-1-yl)-(furan-2-yl)methanone?
The InChIKey is MNLLLHMQIRNXEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClO2/c16-13-8-7-12(10-4-1-2-5-11(10)13)15(17)14-6-3-9-18-14/h1-9H.
What are the key properties of (4-chloronaphthalen-1-yl)-(furan-2-yl)methanone?
(4-chloronaphthalen-1-yl)-(furan-2-yl)methanone has a molecular weight of 256.69 g/mol, XLogP of 4.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloronaphthalen-1-yl)-(furan-2-yl)methanone is sourced from PubChem (CID 79601314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).