(1-amino-2-methylcyclobutyl)methanol

C6H13NO — CID 67296995

IUPAC(1-amino-2-methylcyclobutyl)methanol
SMILESCC1CCC1(N)CO
InChIInChI=1S/C6H13NO/c1-5-2-3-6(5,7)4-8/h5,8H,2-4,7H2,1H3
InChIKeyUZYLUJLBYHIKME-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.11
Rot. Bonds1

About (1-amino-2-methylcyclobutyl)methanol

(1-amino-2-methylcyclobutyl)methanol (PubChem CID 67296995) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is (1-amino-2-methylcyclobutyl)methanol.

Molecular Properties

Compound Name(1-amino-2-methylcyclobutyl)methanol
PubChem CID67296995
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name(1-amino-2-methylcyclobutyl)methanol
SMILESCC1CCC1(N)CO
InChIInChI=1S/C6H13NO/c1-5-2-3-6(5,7)4-8/h5,8H,2-4,7H2,1H3
InChIKeyUZYLUJLBYHIKME-UHFFFAOYSA-N
XLogP0.11
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-amino-2-methylcyclobutyl)methanol?
The IUPAC name of (1-amino-2-methylcyclobutyl)methanol (CID 67296995) is (1-amino-2-methylcyclobutyl)methanol.
What is the SMILES notation for (1-amino-2-methylcyclobutyl)methanol?
The canonical SMILES for (1-amino-2-methylcyclobutyl)methanol is CC1CCC1(N)CO.
What is the InChIKey of (1-amino-2-methylcyclobutyl)methanol?
The InChIKey is UZYLUJLBYHIKME-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-5-2-3-6(5,7)4-8/h5,8H,2-4,7H2,1H3.
What are the key properties of (1-amino-2-methylcyclobutyl)methanol?
(1-amino-2-methylcyclobutyl)methanol has a molecular weight of 115.18 g/mol, XLogP of 0.11, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-amino-2-methylcyclobutyl)methanol is sourced from PubChem (CID 67296995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).