2-cyclobutyl-N,2-dimethyloxan-4-amine

C11H21NO — CID 131020831

IUPAC2-cyclobutyl-N,2-dimethyloxan-4-amine
SMILESCNC1CCOC(C)(C2CCC2)C1
InChIInChI=1S/C11H21NO/c1-11(9-4-3-5-9)8-10(12-2)6-7-13-11/h9-10,12H,3-8H2,1-2H3
InChIKeyAMRBOMMBXXGUFX-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.94
Rot. Bonds2

About 2-cyclobutyl-N,2-dimethyloxan-4-amine

2-cyclobutyl-N,2-dimethyloxan-4-amine (PubChem CID 131020831) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-cyclobutyl-N,2-dimethyloxan-4-amine.

Molecular Properties

Compound Name2-cyclobutyl-N,2-dimethyloxan-4-amine
PubChem CID131020831
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-cyclobutyl-N,2-dimethyloxan-4-amine
SMILESCNC1CCOC(C)(C2CCC2)C1
InChIInChI=1S/C11H21NO/c1-11(9-4-3-5-9)8-10(12-2)6-7-13-11/h9-10,12H,3-8H2,1-2H3
InChIKeyAMRBOMMBXXGUFX-UHFFFAOYSA-N
XLogP1.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyl-2-methyloxan-4-amine
CID 126985978
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CID 11469119
(3aR,7aS)-7a-methyl-3,3a,4,5,6,7-hexahydro-2H-1-benzofuran
CID 124636274
8a-methyl-2,3,4,4a,5,6,7,8-octahydrochromene
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(2R)-2-cyclohexyl-2-methyloxirane
CID 101039402
N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine
CID 83852999
1-(2-cyclobutyloxolan-2-yl)-N-methylmethanamine
CID 130609933
(7aR)-5,7a-dimethyl-3,3a,4,5,6,7-hexahydro-2H-1-benzofuran
CID 144757851
4-(methylamino)-1-(5-oxaspiro[3.5]nonan-8-yl)cyclohexan-1-ol
CID 79923576
3-N-(2,2-dimethyloxan-4-yl)butane-2,3-diamine
CID 130574119
N-(1-methylcyclopentyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79895290
N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79895072

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N,2-dimethyloxan-4-amine?
The IUPAC name of 2-cyclobutyl-N,2-dimethyloxan-4-amine (CID 131020831) is 2-cyclobutyl-N,2-dimethyloxan-4-amine.
What is the SMILES notation for 2-cyclobutyl-N,2-dimethyloxan-4-amine?
The canonical SMILES for 2-cyclobutyl-N,2-dimethyloxan-4-amine is CNC1CCOC(C)(C2CCC2)C1.
What is the InChIKey of 2-cyclobutyl-N,2-dimethyloxan-4-amine?
The InChIKey is AMRBOMMBXXGUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-11(9-4-3-5-9)8-10(12-2)6-7-13-11/h9-10,12H,3-8H2,1-2H3.
What are the key properties of 2-cyclobutyl-N,2-dimethyloxan-4-amine?
2-cyclobutyl-N,2-dimethyloxan-4-amine has a molecular weight of 183.29 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N,2-dimethyloxan-4-amine is sourced from PubChem (CID 131020831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).