3-amino-1-propan-2-ylcyclobutan-1-ol

C7H15NO — CID 80561373

IUPAC3-amino-1-propan-2-ylcyclobutan-1-ol
SMILESCC(C)C1(O)CC(N)C1
InChIInChI=1S/C7H15NO/c1-5(2)7(9)3-6(8)4-7/h5-6,9H,3-4,8H2,1-2H3
InChIKeyOHHNZOKDGDJCMR-UHFFFAOYSA-N
MW129.20 g/mol
LogP0.49
Rot. Bonds1

About 3-amino-1-propan-2-ylcyclobutan-1-ol

3-amino-1-propan-2-ylcyclobutan-1-ol (PubChem CID 80561373) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is 3-amino-1-propan-2-ylcyclobutan-1-ol.

Molecular Properties

Compound Name3-amino-1-propan-2-ylcyclobutan-1-ol
PubChem CID80561373
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name3-amino-1-propan-2-ylcyclobutan-1-ol
SMILESCC(C)C1(O)CC(N)C1
InChIInChI=1S/C7H15NO/c1-5(2)7(9)3-6(8)4-7/h5-6,9H,3-4,8H2,1-2H3
InChIKeyOHHNZOKDGDJCMR-UHFFFAOYSA-N
XLogP0.49
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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1-(3-amino-1-hydroxycyclobutyl)-2-methylpropan-1-one
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(3aR,6aS)-5-methyl-2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ol
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3-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol
CID 171953091
3-amino-1-ethylcyclobutan-1-ol
CID 80561372
(1S,6S)-6-methyl-3-propan-2-ylbicyclo[4.1.0]heptan-3-ol
CID 67160199
2-(4-hydroxy-4-propan-2-ylcyclohexyl)acetamide
CID 58456192
2-methyl-4-propan-2-ylpiperidin-4-ol
CID 83815565
cis-(1R,3R)-3-methyl-1-propan-2-ylcyclohexan-1-ol
CID 118858373
3,3-dimethylcyclobutan-1-amine
CID 14988402
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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-propan-2-ylcyclobutan-1-ol?
The IUPAC name of 3-amino-1-propan-2-ylcyclobutan-1-ol (CID 80561373) is 3-amino-1-propan-2-ylcyclobutan-1-ol.
What is the SMILES notation for 3-amino-1-propan-2-ylcyclobutan-1-ol?
The canonical SMILES for 3-amino-1-propan-2-ylcyclobutan-1-ol is CC(C)C1(O)CC(N)C1.
What is the InChIKey of 3-amino-1-propan-2-ylcyclobutan-1-ol?
The InChIKey is OHHNZOKDGDJCMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-5(2)7(9)3-6(8)4-7/h5-6,9H,3-4,8H2,1-2H3.
What are the key properties of 3-amino-1-propan-2-ylcyclobutan-1-ol?
3-amino-1-propan-2-ylcyclobutan-1-ol has a molecular weight of 129.20 g/mol, XLogP of 0.49, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-propan-2-ylcyclobutan-1-ol is sourced from PubChem (CID 80561373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).