2-cyclobutyl-2-methyloxan-4-amine

C10H19NO — CID 126985978

IUPAC2-cyclobutyl-2-methyloxan-4-amine
SMILESCC1(C2CCC2)CC(N)CCO1
InChIInChI=1S/C10H19NO/c1-10(8-3-2-4-8)7-9(11)5-6-12-10/h8-9H,2-7,11H2,1H3
InChIKeyVYJILXAGZLYGDE-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.68
Rot. Bonds1

About 2-cyclobutyl-2-methyloxan-4-amine

2-cyclobutyl-2-methyloxan-4-amine (PubChem CID 126985978) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-cyclobutyl-2-methyloxan-4-amine.

Molecular Properties

Compound Name2-cyclobutyl-2-methyloxan-4-amine
PubChem CID126985978
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-cyclobutyl-2-methyloxan-4-amine
SMILESCC1(C2CCC2)CC(N)CCO1
InChIInChI=1S/C10H19NO/c1-10(8-3-2-4-8)7-9(11)5-6-12-10/h8-9H,2-7,11H2,1H3
InChIKeyVYJILXAGZLYGDE-UHFFFAOYSA-N
XLogP1.68
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyl-N,2-dimethyloxan-4-amine
CID 131020831
(3aR,7aR)-7a-methyl-3,3a,4,5,6,7-hexahydro-2H-1-benzofuran
CID 11469119
(3aR,7aS)-7a-methyl-3,3a,4,5,6,7-hexahydro-2H-1-benzofuran
CID 124636274
2,2-dimethyloxolan-3-amine
CID 59657974
8a-methyl-2,3,4,4a,5,6,7,8-octahydrochromene
CID 58800826
5-oxaspiro[3.5]nonane-2,8-diamine
CID 167736424
(2R)-2-cyclohexyl-2-methyloxirane
CID 101039402
3-methyl-3-(1-oxaspiro[5.5]undecan-4-yl)cyclopentan-1-amine
CID 116538915
3-methyl-3-(oxan-3-yl)cyclopentan-1-amine
CID 107137841
(2-cyclohexyl-2-methyloxolan-3-yl)methanamine
CID 105451085
(4S,6R)-8-methyl-1-oxa-8-azaspiro[5.5]undecan-4-amine
CID 99110024
(7aR)-5,7a-dimethyl-3,3a,4,5,6,7-hexahydro-2H-1-benzofuran
CID 144757851

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-2-methyloxan-4-amine?
The IUPAC name of 2-cyclobutyl-2-methyloxan-4-amine (CID 126985978) is 2-cyclobutyl-2-methyloxan-4-amine.
What is the SMILES notation for 2-cyclobutyl-2-methyloxan-4-amine?
The canonical SMILES for 2-cyclobutyl-2-methyloxan-4-amine is CC1(C2CCC2)CC(N)CCO1.
What is the InChIKey of 2-cyclobutyl-2-methyloxan-4-amine?
The InChIKey is VYJILXAGZLYGDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-10(8-3-2-4-8)7-9(11)5-6-12-10/h8-9H,2-7,11H2,1H3.
What are the key properties of 2-cyclobutyl-2-methyloxan-4-amine?
2-cyclobutyl-2-methyloxan-4-amine has a molecular weight of 169.27 g/mol, XLogP of 1.68, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-2-methyloxan-4-amine is sourced from PubChem (CID 126985978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).