[1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol

C11H19N3O — CID 115733170

IUPAC[1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol
SMILESCCn1ccnc1CNC1(CO)CCC1
InChIInChI=1S/C11H19N3O/c1-2-14-7-6-12-10(14)8-13-11(9-15)4-3-5-11/h6-7,13,15H,2-5,8-9H2,1H3
InChIKeyXJJBXSOFICIKTE-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.91
Rot. Bonds5

About [1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol

[1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol (PubChem CID 115733170) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is [1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol.

Molecular Properties

Compound Name[1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol
PubChem CID115733170
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name[1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol
SMILESCCn1ccnc1CNC1(CO)CCC1
InChIInChI=1S/C11H19N3O/c1-2-14-7-6-12-10(14)8-13-11(9-15)4-3-5-11/h6-7,13,15H,2-5,8-9H2,1H3
InChIKeyXJJBXSOFICIKTE-UHFFFAOYSA-N
XLogP0.91
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[(1-ethylimidazol-2-yl)methylamino]-3-methylcyclohexyl]methanol
CID 62552492
[1-[(1-methylimidazol-2-yl)methylamino]cyclopropyl]methanol
CID 115763066
N-[(1-ethylimidazol-2-yl)methyl]propan-1-amine
CID 46784352
N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine
CID 83229115
[1-[2-(2-methylimidazol-1-yl)ethylamino]cyclohexyl]methanol
CID 55082128
(2R)-2-[(1-ethylimidazol-2-yl)methylamino]propan-1-ol
CID 114985494
1-[(1-ethylimidazol-2-yl)methyl]cycloheptan-1-ol
CID 79744578
3-[[(1-ethylimidazol-2-yl)methylamino]methyl]oxolan-3-ol
CID 103848413
4-[[(1-ethylimidazol-2-yl)methylamino]methyl]cyclohexan-1-ol
CID 106126176
1-(1-ethylimidazol-2-yl)-N-[(4-methyloxan-4-yl)methyl]methanamine
CID 103743599
2-cyclohexyl-N-[(1-ethylimidazol-2-yl)methyl]ethanamine
CID 55064443
1-(1-aminocyclobutyl)-2-(1-ethylimidazol-2-yl)ethanone
CID 116598354

Frequently Asked Questions

What is the IUPAC name of [1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol?
The IUPAC name of [1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol (CID 115733170) is [1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol.
What is the SMILES notation for [1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol?
The canonical SMILES for [1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol is CCn1ccnc1CNC1(CO)CCC1.
What is the InChIKey of [1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol?
The InChIKey is XJJBXSOFICIKTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-2-14-7-6-12-10(14)8-13-11(9-15)4-3-5-11/h6-7,13,15H,2-5,8-9H2,1H3.
What are the key properties of [1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol?
[1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol has a molecular weight of 209.29 g/mol, XLogP of 0.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol is sourced from PubChem (CID 115733170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).