(6-chloroindol-1-yl)-pyridin-2-ylmethanone

C14H9ClN2O — CID 175014523

IUPAC(6-chloroindol-1-yl)-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)n1ccc2ccc(Cl)cc21
InChIInChI=1S/C14H9ClN2O/c15-11-5-4-10-6-8-17(13(10)9-11)14(18)12-3-1-2-7-16-12/h1-9H
InChIKeyBRCGPWGLBGYYOX-UHFFFAOYSA-N
MW256.69 g/mol
LogP3.38
Rot. Bonds1

About (6-chloroindol-1-yl)-pyridin-2-ylmethanone

(6-chloroindol-1-yl)-pyridin-2-ylmethanone (PubChem CID 175014523) has the molecular formula C14H9ClN2O and a molecular weight of 256.69 g/mol. Its IUPAC name is (6-chloroindol-1-yl)-pyridin-2-ylmethanone.

Molecular Properties

Compound Name(6-chloroindol-1-yl)-pyridin-2-ylmethanone
PubChem CID175014523
Molecular FormulaC14H9ClN2O
Molecular Weight256.69 g/mol
Exact Mass256.04
IUPAC Name(6-chloroindol-1-yl)-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)n1ccc2ccc(Cl)cc21
InChIInChI=1S/C14H9ClN2O/c15-11-5-4-10-6-8-17(13(10)9-11)14(18)12-3-1-2-7-16-12/h1-9H
InChIKeyBRCGPWGLBGYYOX-UHFFFAOYSA-N
XLogP3.38
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.69
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[1-(pyridine-2-carbonyl)indol-5-yl]benzamide
CID 53317539
methyl 1-(pyridine-2-carbonyl)indole-5-carboxylate
CID 175014240
(6-chloropyrimidin-4-yl)-indol-1-ylmethanone
CID 58386700
(2,5-dichlorophenyl)-pyridin-2-ylmethanone
CID 16638529
[4-(2,5-dichlorophenyl)sulfonylpiperazin-1-yl]-pyridin-2-ylmethanone
CID 9496675
ethane;pyridine-2-carbonyl chloride
CID 158598971
N-(2-bromo-5-chlorophenyl)pyridine-2-carboxamide
CID 81271946
(3,5-dichlorophenyl)-pyridin-2-ylmethanone
CID 24723586
(2,6-dichloroquinolin-4-yl)-pyridin-2-ylmethanone
CID 125473502
6-chloro-3-[1-(pyridine-2-carbonyl)piperidin-4-yl]-1H-benzimidazol-2-one
CID 172968096
N-[[7-chloro-2-oxo-1-(2-phenoxyethyl)quinolin-3-yl]methyl]pyridine-2-carboxamide
CID 163359187
N-(6-chloroquinolin-4-yl)pyridine-2-carboxamide
CID 17016566

Frequently Asked Questions

What is the IUPAC name of (6-chloroindol-1-yl)-pyridin-2-ylmethanone?
The IUPAC name of (6-chloroindol-1-yl)-pyridin-2-ylmethanone (CID 175014523) is (6-chloroindol-1-yl)-pyridin-2-ylmethanone.
What is the SMILES notation for (6-chloroindol-1-yl)-pyridin-2-ylmethanone?
The canonical SMILES for (6-chloroindol-1-yl)-pyridin-2-ylmethanone is O=C(c1ccccn1)n1ccc2ccc(Cl)cc21.
What is the InChIKey of (6-chloroindol-1-yl)-pyridin-2-ylmethanone?
The InChIKey is BRCGPWGLBGYYOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O/c15-11-5-4-10-6-8-17(13(10)9-11)14(18)12-3-1-2-7-16-12/h1-9H.
What are the key properties of (6-chloroindol-1-yl)-pyridin-2-ylmethanone?
(6-chloroindol-1-yl)-pyridin-2-ylmethanone has a molecular weight of 256.69 g/mol, XLogP of 3.38, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloroindol-1-yl)-pyridin-2-ylmethanone is sourced from PubChem (CID 175014523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).