3-amino-2,2-dimethylcyclobutan-1-ol

C6H13NO — CID 75481529

IUPAC3-amino-2,2-dimethylcyclobutan-1-ol
SMILESCC1(C)C(N)CC1O
InChIInChI=1S/C6H13NO/c1-6(2)4(7)3-5(6)8/h4-5,8H,3,7H2,1-2H3
InChIKeyMLXIQOVWRZVXSV-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.10
Rot. Bonds

About 3-amino-2,2-dimethylcyclobutan-1-ol

3-amino-2,2-dimethylcyclobutan-1-ol (PubChem CID 75481529) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 3-amino-2,2-dimethylcyclobutan-1-ol.

Molecular Properties

Compound Name3-amino-2,2-dimethylcyclobutan-1-ol
PubChem CID75481529
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name3-amino-2,2-dimethylcyclobutan-1-ol
SMILESCC1(C)C(N)CC1O
InChIInChI=1S/C6H13NO/c1-6(2)4(7)3-5(6)8/h4-5,8H,3,7H2,1-2H3
InChIKeyMLXIQOVWRZVXSV-UHFFFAOYSA-N
XLogP0.10
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclobutanol, 3-amino-2,2,4,4-tetramethyl-
CID 203376
[1-(Aminomethyl)cyclobutyl]methanol
CID 22639984
(1-(1-Aminoethyl)cyclobutyl)methanol
CID 69063503
3-Amino-2,2-dimethylcyclobutan-1-ol hydrochloride
CID 75481528
3-Methoxy-2,2-dimethylcyclobutan-1-amine
CID 66357768
3-(Aminomethyl)-3-methylcyclobutan-1-ol
CID 115011071
rac-(1R,4S)-4-amino-2,2-dimethylcyclobutan-1-ol hydrochloride
CID 137943933
3-Amino-2,2,4,4-tetramethylcyclobutan-1-ol hydrochloride
CID 138987813
3-Amino-2-methylcyclobutan-1-ol
CID 165589103
(2-Amino-1-methylcyclobutyl)methanol hydrochloride
CID 165881030
Cyclobutanol, 3-amino-2,2-dimethyl-, hydrochloride (1:1), (1R,3S)-rel-
CID 91663854
rac-(1R,4S)-4-amino-2,2-dimethylcyclobutan-1-ol
CID 137943934

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2-dimethylcyclobutan-1-ol?
The IUPAC name of 3-amino-2,2-dimethylcyclobutan-1-ol (CID 75481529) is 3-amino-2,2-dimethylcyclobutan-1-ol.
What is the SMILES notation for 3-amino-2,2-dimethylcyclobutan-1-ol?
The canonical SMILES for 3-amino-2,2-dimethylcyclobutan-1-ol is CC1(C)C(N)CC1O.
What is the InChIKey of 3-amino-2,2-dimethylcyclobutan-1-ol?
The InChIKey is MLXIQOVWRZVXSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-6(2)4(7)3-5(6)8/h4-5,8H,3,7H2,1-2H3.
What are the key properties of 3-amino-2,2-dimethylcyclobutan-1-ol?
3-amino-2,2-dimethylcyclobutan-1-ol has a molecular weight of 115.18 g/mol, XLogP of 0.10, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2-dimethylcyclobutan-1-ol is sourced from PubChem (CID 75481529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).