1-cyclobutyl-5-methoxyhexan-2-amine

C11H23NO — CID 105151744

IUPAC1-cyclobutyl-5-methoxyhexan-2-amine
SMILESCOC(C)CCC(N)CC1CCC1
InChIInChI=1S/C11H23NO/c1-9(13-2)6-7-11(12)8-10-4-3-5-10/h9-11H,3-8,12H2,1-2H3
InChIKeyAITBAKWDOXRZGS-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.32
Rot. Bonds6

About 1-cyclobutyl-5-methoxyhexan-2-amine

1-cyclobutyl-5-methoxyhexan-2-amine (PubChem CID 105151744) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-cyclobutyl-5-methoxyhexan-2-amine.

Molecular Properties

Compound Name1-cyclobutyl-5-methoxyhexan-2-amine
PubChem CID105151744
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-cyclobutyl-5-methoxyhexan-2-amine
SMILESCOC(C)CCC(N)CC1CCC1
InChIInChI=1S/C11H23NO/c1-9(13-2)6-7-11(12)8-10-4-3-5-10/h9-11H,3-8,12H2,1-2H3
InChIKeyAITBAKWDOXRZGS-UHFFFAOYSA-N
XLogP2.32
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-5-methoxyhexan-2-amine
CID 105135842
1-cyclohexyl-4-methoxypentan-1-amine
CID 105079909
(2S)-2-amino-5-methoxyhexan-1-ol
CID 58308158
4-cyclobutyl-1-N,1-N-dimethylbutane-1,3-diamine
CID 115346236
1-cyclopentyl-N-ethyl-5-methoxyhexan-2-amine
CID 105138937
1-cyclohexyl-5-methoxypentan-2-amine
CID 65092031
(2S)-1-cyclobutylpropan-2-amine
CID 66713874
(2R)-1-cyclobutylpropan-2-amine
CID 124506916
1-cyclohexyl-5-methoxy-5-methylhexan-2-amine
CID 103031159
1,3-dicyclopentylpropan-2-amine
CID 58122660
1-cycloheptyl-4-cyclohexylbutan-2-amine
CID 114193048
1-cyclopentyldecan-2-amine
CID 115835607

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-5-methoxyhexan-2-amine?
The IUPAC name of 1-cyclobutyl-5-methoxyhexan-2-amine (CID 105151744) is 1-cyclobutyl-5-methoxyhexan-2-amine.
What is the SMILES notation for 1-cyclobutyl-5-methoxyhexan-2-amine?
The canonical SMILES for 1-cyclobutyl-5-methoxyhexan-2-amine is COC(C)CCC(N)CC1CCC1.
What is the InChIKey of 1-cyclobutyl-5-methoxyhexan-2-amine?
The InChIKey is AITBAKWDOXRZGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-9(13-2)6-7-11(12)8-10-4-3-5-10/h9-11H,3-8,12H2,1-2H3.
What are the key properties of 1-cyclobutyl-5-methoxyhexan-2-amine?
1-cyclobutyl-5-methoxyhexan-2-amine has a molecular weight of 185.31 g/mol, XLogP of 2.32, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-5-methoxyhexan-2-amine is sourced from PubChem (CID 105151744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).