1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol

C10H20O — CID 171752965

IUPAC1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol
SMILESC[C@H](C(C)(C)C)C1(O)CCC1
InChIInChI=1S/C10H20O/c1-8(9(2,3)4)10(11)6-5-7-10/h8,11H,5-7H2,1-4H3/t8-/m1/s1
InChIKeyXRTBBXOJSOXALK-MRVPVSSYSA-N
MW156.27 g/mol
LogP2.58
Rot. Bonds1

About 1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol

1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol (PubChem CID 171752965) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol.

Molecular Properties

Compound Name1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol
PubChem CID171752965
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol
SMILESC[C@H](C(C)(C)C)C1(O)CCC1
InChIInChI=1S/C10H20O/c1-8(9(2,3)4)10(11)6-5-7-10/h8,11H,5-7H2,1-4H3/t8-/m1/s1
InChIKeyXRTBBXOJSOXALK-MRVPVSSYSA-N
XLogP2.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(2S)-3,3-dimethylbutan-2-yl]-1-methoxycyclobutane
CID 171753288
1-(1-hydroxycyclohexyl)-2,2,4-trimethylpentane-1,3-diol
CID 23168890
1-(1-amino-2-methylpropyl)cyclopentan-1-ol
CID 18373867
N,N'-bis[(1R)-1-(1-hydroxycyclobutyl)-2,2-dimethylpropyl]propanediamide
CID 69007042
N,N'-bis[(1R)-1-(1-hydroxycyclopentyl)-2,2-dimethylpropyl]oxamide
CID 69011772
1-[(1S)-1-aminoethyl]cyclohexan-1-ol
CID 92975390
1-(dichloromethyl)cyclobutan-1-ol
CID 175326256
tert-butyl 2-(1-hydroxy-4,4-dimethylcycloheptyl)propanoate
CID 66339645
1-(1-aminopropan-2-yl)cyclopentan-1-ol
CID 79127833
3-amino-2-(1-hydroxycyclobutyl)butanamide
CID 91827576
1-tert-butyl-1-methylcyclobutane;2-methylpropane
CID 178126062
cyclobutanol;2,3-dimethylbutan-1-ol;1-propan-2-ylcyclobutan-1-ol
CID 160600152

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol?
The IUPAC name of 1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol (CID 171752965) is 1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol.
What is the SMILES notation for 1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol?
The canonical SMILES for 1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol is C[C@H](C(C)(C)C)C1(O)CCC1.
What is the InChIKey of 1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol?
The InChIKey is XRTBBXOJSOXALK-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H20O/c1-8(9(2,3)4)10(11)6-5-7-10/h8,11H,5-7H2,1-4H3/t8-/m1/s1.
What are the key properties of 1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol?
1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol has a molecular weight of 156.27 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-3,3-dimethylbutan-2-yl]cyclobutan-1-ol is sourced from PubChem (CID 171752965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).