1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol

C15H20N2O2 — CID 106823626

IUPAC1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol
SMILESCCn1nc(CC2(O)CC(OC)C2)c2ccccc21
InChIInChI=1S/C15H20N2O2/c1-3-17-14-7-5-4-6-12(14)13(16-17)10-15(18)8-11(9-15)19-2/h4-7,11,18H,3,8-10H2,1-2H3
InChIKeyIGVNDJGAFGSPOZ-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.14
Rot. Bonds4

About 1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol

1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol (PubChem CID 106823626) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol.

Molecular Properties

Compound Name1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol
PubChem CID106823626
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol
SMILESCCn1nc(CC2(O)CC(OC)C2)c2ccccc21
InChIInChI=1S/C15H20N2O2/c1-3-17-14-7-5-4-6-12(14)13(16-17)10-15(18)8-11(9-15)19-2/h4-7,11,18H,3,8-10H2,1-2H3
InChIKeyIGVNDJGAFGSPOZ-UHFFFAOYSA-N
XLogP2.14
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(1-ethylindazol-3-yl)methyl]cyclopropan-1-amine
CID 66025770
4-[(1-ethylindazol-3-yl)methyl]-1-azabicyclo[3.2.1]octan-4-ol
CID 105365768
1-[(1-ethylindazol-3-yl)methyl]-2,2-dimethylcyclohexan-1-ol
CID 79841973
[1-[(1-ethylindazol-3-yl)methyl]cyclopropyl]methanamine
CID 66026848
[4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol
CID 106825216
3-[(1-ethylindazol-3-yl)methyl]-N,3-dimethylcyclopentan-1-amine
CID 116539007
3-methoxy-1-[(1-methylbenzimidazol-2-yl)methyl]cyclobutan-1-ol
CID 106823868
1-ethyl-3-[(4-fluoropiperidin-4-yl)methyl]indazole
CID 112563254
3-[(4-bromothiolan-3-yl)methyl]-1-ethylindazole
CID 83191263
4-[[(1-ethylindazol-3-yl)methylamino]methyl]oxan-4-ol
CID 81135201
1-[(4-chloro-1-ethyl-3-methylpyrazol-5-yl)methyl]-3-methoxycyclobutan-1-ol
CID 106823582
1-ethyl-3-[[2-(2-methylpropyl)pyrrolidin-2-yl]methyl]indazole
CID 66466531

Frequently Asked Questions

What is the IUPAC name of 1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol?
The IUPAC name of 1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol (CID 106823626) is 1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol.
What is the SMILES notation for 1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol?
The canonical SMILES for 1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol is CCn1nc(CC2(O)CC(OC)C2)c2ccccc21.
What is the InChIKey of 1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol?
The InChIKey is IGVNDJGAFGSPOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-3-17-14-7-5-4-6-12(14)13(16-17)10-15(18)8-11(9-15)19-2/h4-7,11,18H,3,8-10H2,1-2H3.
What are the key properties of 1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol?
1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol has a molecular weight of 260.34 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-ethylindazol-3-yl)methyl]-3-methoxycyclobutan-1-ol is sourced from PubChem (CID 106823626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).