(6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone

C13H8ClNO2 — CID 43463725

IUPAC(6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone
SMILESO=C(c1ccco1)c1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C13H8ClNO2/c14-8-3-4-9-10(7-15-11(9)6-8)13(16)12-2-1-5-17-12/h1-7,15H
InChIKeyNMHWJEGTQKHAFX-UHFFFAOYSA-N
MW245.67 g/mol
LogP3.65
Rot. Bonds2

About (6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone

(6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone (PubChem CID 43463725) has the molecular formula C13H8ClNO2 and a molecular weight of 245.67 g/mol. Its IUPAC name is (6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone.

Molecular Properties

Compound Name(6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone
PubChem CID43463725
Molecular FormulaC13H8ClNO2
Molecular Weight245.67 g/mol
Exact Mass245.02
IUPAC Name(6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone
SMILESO=C(c1ccco1)c1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C13H8ClNO2/c14-8-3-4-9-10(7-15-11(9)6-8)13(16)12-2-1-5-17-12/h1-7,15H
InChIKeyNMHWJEGTQKHAFX-UHFFFAOYSA-N
XLogP3.65
TPSA46.00 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.67
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(6-bromo-1H-indol-3-yl)-(furan-2-yl)methanone
CID 62046001
(6-chloro-1H-indol-3-yl)-(4-chlorophenyl)methanone
CID 43163471
6-chloro-1H-indole-3-carboxamide
CID 130666489
CID 170645729
CID 170645729
1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone
CID 63492171
(5-chloro-2-methylphenyl)-(furan-2-yl)methanone
CID 82883432
2-(6-chloro-1H-indol-3-yl)-2-oxoacetic acid
CID 22556709
7-chloro-3-(furan-2-carbonyl)-4-hydroxy-1H-quinolin-2-one
CID 54735344
(3-chloro-4-fluorophenyl)-(6-chloro-1H-indol-3-yl)methanone
CID 82875840
(4-chloro-3-fluorophenyl)-(6-chloro-1H-indol-3-yl)methanone
CID 107998272
(3-bromo-5-chlorophenyl)-(6-chloro-1H-indol-3-yl)methanone
CID 107949781
(2-bromo-3-methylphenyl)-(6-chloro-1H-indol-3-yl)methanone
CID 107981663

Frequently Asked Questions

What is the IUPAC name of (6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone?
The IUPAC name of (6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone (CID 43463725) is (6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone.
What is the SMILES notation for (6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone?
The canonical SMILES for (6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone is O=C(c1ccco1)c1c[nH]c2cc(Cl)ccc12.
What is the InChIKey of (6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone?
The InChIKey is NMHWJEGTQKHAFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClNO2/c14-8-3-4-9-10(7-15-11(9)6-8)13(16)12-2-1-5-17-12/h1-7,15H.
What are the key properties of (6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone?
(6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone has a molecular weight of 245.67 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone is sourced from PubChem (CID 43463725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).