3-ethyl-6-piperazin-1-yl-2H-indazole

C13H18N4 — CID 59781257

IUPAC3-ethyl-6-piperazin-1-yl-2H-indazole
SMILESCCc1[nH]nc2cc(N3CCNCC3)ccc12
InChIInChI=1S/C13H18N4/c1-2-12-11-4-3-10(9-13(11)16-15-12)17-7-5-14-6-8-17/h3-4,9,14H,2,5-8H2,1H3,(H,15,16)
InChIKeyJYBCQSGFNBISQP-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.53
Rot. Bonds2

About 3-ethyl-6-piperazin-1-yl-2H-indazole

3-ethyl-6-piperazin-1-yl-2H-indazole (PubChem CID 59781257) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-ethyl-6-piperazin-1-yl-2H-indazole.

Molecular Properties

Compound Name3-ethyl-6-piperazin-1-yl-2H-indazole
PubChem CID59781257
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name3-ethyl-6-piperazin-1-yl-2H-indazole
SMILESCCc1[nH]nc2cc(N3CCNCC3)ccc12
InChIInChI=1S/C13H18N4/c1-2-12-11-4-3-10(9-13(11)16-15-12)17-7-5-14-6-8-17/h3-4,9,14H,2,5-8H2,1H3,(H,15,16)
InChIKeyJYBCQSGFNBISQP-UHFFFAOYSA-N
XLogP1.53
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl formate;3-ethyl-6-piperazin-1-yl-2H-indazole
CID 159945137
6-bromo-3-ethyl-1-[(4-methoxyphenyl)methyl]indazole;3-ethyl-1-[(4-methoxyphenyl)methyl]-6-(4-methylpiperazin-1-yl)indazole;3-ethyl-6-(4-methylpiperazin-1-yl)-2H-indazole;1-methylpiperazine
CID 161061761
7-piperazin-1-yl-4-[(7-piperazin-1-ylquinolin-4-yl)disulfanyl]quinoline
CID 139772933
1-ethyl-5-piperazin-1-ylbenzotriazole
CID 84726445
3-ethyl-2H-indazole;molecular hydrogen
CID 156727025
1-cyclopentyl-3-ethyl-6-piperazin-1-ylindazole
CID 23627510
1-(3-ethylphenyl)piperazine;hydrochloride
CID 19911472
2-methyl-6-piperazin-1-ylquinoxaline
CID 117275288
2-methoxy-3-methyl-6-piperazin-1-ylquinoxaline
CID 117275293
1-[4-(4-ethylphenyl)phenyl]piperazine
CID 82092038
ethane;1-(4-ethyl-3-methoxyphenyl)piperazine
CID 176935078
1-(4-chloro-3-methoxyphenyl)piperazine;propane
CID 145414306

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-6-piperazin-1-yl-2H-indazole?
The IUPAC name of 3-ethyl-6-piperazin-1-yl-2H-indazole (CID 59781257) is 3-ethyl-6-piperazin-1-yl-2H-indazole.
What is the SMILES notation for 3-ethyl-6-piperazin-1-yl-2H-indazole?
The canonical SMILES for 3-ethyl-6-piperazin-1-yl-2H-indazole is CCc1[nH]nc2cc(N3CCNCC3)ccc12.
What is the InChIKey of 3-ethyl-6-piperazin-1-yl-2H-indazole?
The InChIKey is JYBCQSGFNBISQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-2-12-11-4-3-10(9-13(11)16-15-12)17-7-5-14-6-8-17/h3-4,9,14H,2,5-8H2,1H3,(H,15,16).
What are the key properties of 3-ethyl-6-piperazin-1-yl-2H-indazole?
3-ethyl-6-piperazin-1-yl-2H-indazole has a molecular weight of 230.31 g/mol, XLogP of 1.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-6-piperazin-1-yl-2H-indazole is sourced from PubChem (CID 59781257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).