2-(1-aminocyclobutyl)propan-1-ol

C7H15NO — CID 55284400

IUPAC2-(1-aminocyclobutyl)propan-1-ol
SMILESCC(CO)C1(N)CCC1
InChIInChI=1S/C7H15NO/c1-6(5-9)7(8)3-2-4-7/h6,9H,2-5,8H2,1H3
InChIKeyYRGPDSYHIYJAHI-UHFFFAOYSA-N
MW129.20 g/mol
LogP0.50
Rot. Bonds2

About 2-(1-aminocyclobutyl)propan-1-ol

2-(1-aminocyclobutyl)propan-1-ol (PubChem CID 55284400) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is 2-(1-aminocyclobutyl)propan-1-ol.

Molecular Properties

Compound Name2-(1-aminocyclobutyl)propan-1-ol
PubChem CID55284400
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name2-(1-aminocyclobutyl)propan-1-ol
SMILESCC(CO)C1(N)CCC1
InChIInChI=1S/C7H15NO/c1-6(5-9)7(8)3-2-4-7/h6,9H,2-5,8H2,1H3
InChIKeyYRGPDSYHIYJAHI-UHFFFAOYSA-N
XLogP0.50
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclobutyl)propan-1-ol?
The IUPAC name of 2-(1-aminocyclobutyl)propan-1-ol (CID 55284400) is 2-(1-aminocyclobutyl)propan-1-ol.
What is the SMILES notation for 2-(1-aminocyclobutyl)propan-1-ol?
The canonical SMILES for 2-(1-aminocyclobutyl)propan-1-ol is CC(CO)C1(N)CCC1.
What is the InChIKey of 2-(1-aminocyclobutyl)propan-1-ol?
The InChIKey is YRGPDSYHIYJAHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-6(5-9)7(8)3-2-4-7/h6,9H,2-5,8H2,1H3.
What are the key properties of 2-(1-aminocyclobutyl)propan-1-ol?
2-(1-aminocyclobutyl)propan-1-ol has a molecular weight of 129.20 g/mol, XLogP of 0.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclobutyl)propan-1-ol is sourced from PubChem (CID 55284400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).