1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone

C15H17N3O2 — CID 15268068

IUPAC1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone
SMILESCC(=O)n1nc(C(=O)N2CCCCC2)c2ccccc21
InChIInChI=1S/C15H17N3O2/c1-11(19)18-13-8-4-3-7-12(13)14(16-18)15(20)17-9-5-2-6-10-17/h3-4,7-8H,2,5-6,9-10H2,1H3
InChIKeyJNFRXBAHUKBIND-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.32
Rot. Bonds1

About 1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone

1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone (PubChem CID 15268068) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone.

Molecular Properties

Compound Name1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone
PubChem CID15268068
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone
SMILESCC(=O)n1nc(C(=O)N2CCCCC2)c2ccccc21
InChIInChI=1S/C15H17N3O2/c1-11(19)18-13-8-4-3-7-12(13)14(16-18)15(20)17-9-5-2-6-10-17/h3-4,7-8H,2,5-6,9-10H2,1H3
InChIKeyJNFRXBAHUKBIND-UHFFFAOYSA-N
XLogP2.32
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(1-methylindazol-3-yl)-pyrrolidin-1-ylmethanone
CID 110848618
(1-bromoindazol-3-yl)-pyrrolidin-1-ylmethanone
CID 123818854
1-piperidin-1-yl-2-[3-(pyrrolidine-1-carbonyl)indazol-1-yl]ethanone
CID 46378636
1-[3-(azepane-1-carbonyl)indol-1-yl]ethanone
CID 113207907
N-(4-acetylphenyl)-2-[3-(pyrrolidine-1-carbonyl)indazol-1-yl]acetamide
CID 46378627
(4-bromopiperidin-1-yl)-(1-methylindazol-3-yl)methanone
CID 103122439
1-(4-phenylpiperazin-1-yl)-2-[3-(pyrrolidine-1-carbonyl)indazol-1-yl]ethanone
CID 50806834
1,2-benzothiazol-3-yl(piperidin-1-yl)methanone
CID 6625272
1-[4-[3-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carbonyl]piperazin-1-yl]ethanone
CID 109068040
4-(azetidine-1-carbonyl)-2-ethylphthalazin-1-one
CID 26925219
N-(4-chlorophenyl)-2-[3-(pyrrolidine-1-carbonyl)indazol-1-yl]acetamide
CID 22583453
[3-(4-cyclohexylpiperazin-1-yl)azetidin-1-yl]-(1-methylindazol-3-yl)methanone
CID 126892556

Frequently Asked Questions

What is the IUPAC name of 1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone?
The IUPAC name of 1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone (CID 15268068) is 1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone.
What is the SMILES notation for 1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone?
The canonical SMILES for 1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone is CC(=O)n1nc(C(=O)N2CCCCC2)c2ccccc21.
What is the InChIKey of 1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone?
The InChIKey is JNFRXBAHUKBIND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-11(19)18-13-8-4-3-7-12(13)14(16-18)15(20)17-9-5-2-6-10-17/h3-4,7-8H,2,5-6,9-10H2,1H3.
What are the key properties of 1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone?
1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone has a molecular weight of 271.32 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(piperidine-1-carbonyl)indazol-1-yl]ethanone is sourced from PubChem (CID 15268068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).