N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide

C14H12ClN3O — CID 115608654

IUPACN-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide
SMILESO=C(Nc1ccc(Cl)nn1)c1ccc2c(c1)CCC2
InChIInChI=1S/C14H12ClN3O/c15-12-6-7-13(18-17-12)16-14(19)11-5-4-9-2-1-3-10(9)8-11/h4-8H,1-3H2,(H,16,18,19)
InChIKeyKGFSOZXVLVKJJY-UHFFFAOYSA-N
MW273.72 g/mol
LogP2.87
Rot. Bonds2

About N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide

N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide (PubChem CID 115608654) has the molecular formula C14H12ClN3O and a molecular weight of 273.72 g/mol. Its IUPAC name is N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide.

Molecular Properties

Compound NameN-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide
PubChem CID115608654
Molecular FormulaC14H12ClN3O
Molecular Weight273.72 g/mol
Exact Mass273.07
IUPAC NameN-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide
SMILESO=C(Nc1ccc(Cl)nn1)c1ccc2c(c1)CCC2
InChIInChI=1S/C14H12ClN3O/c15-12-6-7-13(18-17-12)16-14(19)11-5-4-9-2-1-3-10(9)8-11/h4-8H,1-3H2,(H,16,18,19)
InChIKeyKGFSOZXVLVKJJY-UHFFFAOYSA-N
XLogP2.87
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.72
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-N-(6-chloropyridazin-3-yl)benzamide
CID 113230922
3-chloro-N-(6-chloropyridazin-3-yl)-4-fluorobenzamide
CID 115737291
4-bromo-N-(6-chloropyridazin-3-yl)-3-nitrobenzamide
CID 115608655
N-(6-chloropyridazin-3-yl)-3-methyl-4-nitrobenzamide
CID 115608624
N-(3-chloro-2-methylphenyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 9011354
N-(6-chloropyridazin-3-yl)-4-(methylsulfonylmethyl)benzamide
CID 56805495
N-(2-bromo-3-chlorophenyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 103479830
N-(5-tert-butyl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indene-5-carboxamide
CID 115589899
N-(4-fluorophenyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 17495760
N-(6-chloropyridazin-3-yl)-3-fluoro-5-methylbenzamide
CID 115666665
2-(2,3-dihydro-1H-indene-5-carbonylamino)pyridine-3-carboxylic acid
CID 63652531
N-(6-chloropyridazin-3-yl)-4-methoxy-3-nitrobenzamide
CID 115608630

Frequently Asked Questions

What is the IUPAC name of N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide?
The IUPAC name of N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide (CID 115608654) is N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide.
What is the SMILES notation for N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide?
The canonical SMILES for N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide is O=C(Nc1ccc(Cl)nn1)c1ccc2c(c1)CCC2.
What is the InChIKey of N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide?
The InChIKey is KGFSOZXVLVKJJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3O/c15-12-6-7-13(18-17-12)16-14(19)11-5-4-9-2-1-3-10(9)8-11/h4-8H,1-3H2,(H,16,18,19).
What are the key properties of N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide?
N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide has a molecular weight of 273.72 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloropyridazin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide is sourced from PubChem (CID 115608654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).