4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole

C15H22N4 — CID 134383206

IUPAC4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole
SMILESCCN1CCN(Cc2cccc3c2cnn3C)CC1
InChIInChI=1S/C15H22N4/c1-3-18-7-9-19(10-8-18)12-13-5-4-6-15-14(13)11-16-17(15)2/h4-6,11H,3,7-10,12H2,1-2H3
InChIKeyYJNOBICPTGPVFU-UHFFFAOYSA-N
MW258.37 g/mol
LogP1.71
Rot. Bonds3

About 4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole

4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole (PubChem CID 134383206) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is 4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole.

Molecular Properties

Compound Name4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole
PubChem CID134383206
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole
SMILESCCN1CCN(Cc2cccc3c2cnn3C)CC1
InChIInChI=1S/C15H22N4/c1-3-18-7-9-19(10-8-18)12-13-5-4-6-15-14(13)11-16-17(15)2/h4-6,11H,3,7-10,12H2,1-2H3
InChIKeyYJNOBICPTGPVFU-UHFFFAOYSA-N
XLogP1.71
TPSA24.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-4-[(4-propan-2-ylpiperazin-1-yl)methyl]indazole
CID 134379965
1-methyl-4-[3-(4-methylpiperazin-1-yl)propyl]indazole
CID 170862469
4-(fluoromethyl)-1-methylindazole
CID 84651809
1-methyl-4-[(4-methylindazol-1-yl)methyl]indazole
CID 168918626
2-bromo-6-[(4-ethylpiperazin-1-yl)methyl]phenol
CID 82974919
1,4-bis(naphthalen-1-ylmethyl)piperazine
CID 4846171
1-(1,3-benzodioxol-4-ylmethyl)-4-ethylpiperazine
CID 70905419
5,5-dimethyl-2-[(1-methylindazol-4-yl)methylamino]hexanoic acid
CID 175558811
5-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-3-methylpyridazino[4,5-b]indol-4-one
CID 53043907
1-ethyl-4-[(3-fluoro-4-pyridinyl)methyl]piperazine
CID 126759788
1-[(5-cyclopropyl-1-methylpyrazol-4-yl)methyl]-4-[(2-methylphenyl)methyl]piperazine
CID 56881894
N-[[2-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120969799

Frequently Asked Questions

What is the IUPAC name of 4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole?
The IUPAC name of 4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole (CID 134383206) is 4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole.
What is the SMILES notation for 4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole?
The canonical SMILES for 4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole is CCN1CCN(Cc2cccc3c2cnn3C)CC1.
What is the InChIKey of 4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole?
The InChIKey is YJNOBICPTGPVFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-3-18-7-9-19(10-8-18)12-13-5-4-6-15-14(13)11-16-17(15)2/h4-6,11H,3,7-10,12H2,1-2H3.
What are the key properties of 4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole?
4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole has a molecular weight of 258.37 g/mol, XLogP of 1.71, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-ethylpiperazin-1-yl)methyl]-1-methylindazole is sourced from PubChem (CID 134383206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).