3-cyclobutyl-3-methoxybutan-1-amine

C9H19NO — CID 105430822

IUPAC3-cyclobutyl-3-methoxybutan-1-amine
SMILESCOC(C)(CCN)C1CCC1
InChIInChI=1S/C9H19NO/c1-9(11-2,6-7-10)8-4-3-5-8/h8H,3-7,10H2,1-2H3
InChIKeyBEXPROOQGFNJPH-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.54
Rot. Bonds4

About 3-cyclobutyl-3-methoxybutan-1-amine

3-cyclobutyl-3-methoxybutan-1-amine (PubChem CID 105430822) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 3-cyclobutyl-3-methoxybutan-1-amine.

Molecular Properties

Compound Name3-cyclobutyl-3-methoxybutan-1-amine
PubChem CID105430822
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name3-cyclobutyl-3-methoxybutan-1-amine
SMILESCOC(C)(CCN)C1CCC1
InChIInChI=1S/C9H19NO/c1-9(11-2,6-7-10)8-4-3-5-8/h8H,3-7,10H2,1-2H3
InChIKeyBEXPROOQGFNJPH-UHFFFAOYSA-N
XLogP1.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cycloheptyl-2-methoxypropan-1-ol
CID 105442303
5-amino-2-cyclobutyl-1-methoxypentan-2-ol
CID 103391375
(1-cyclopentyl-1-methoxyethyl)cyclopentane
CID 70648632
3-N-(2-cyclobutyl-2-methylpropyl)-3-methylbutane-1,3-diamine
CID 115135098
5-amino-2-cyclobutylpentan-2-ol
CID 130580664
3-cycloheptyl-3-methoxybutanoic acid
CID 105467922
cyclopentane;[difluoro(methoxy)methyl]cyclobutane
CID 54534938
3-cyclopropylbutane-1,3-diamine
CID 150088317
(1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane
CID 89106500
2-cyclopropylpentan-2-ylcyclobutane
CID 173163252
1,1-dicyclohexylpropane-1,3-diamine
CID 57076927
3-amino-2-cyclobutyl-2-methylpropanoic acid
CID 106487162

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-3-methoxybutan-1-amine?
The IUPAC name of 3-cyclobutyl-3-methoxybutan-1-amine (CID 105430822) is 3-cyclobutyl-3-methoxybutan-1-amine.
What is the SMILES notation for 3-cyclobutyl-3-methoxybutan-1-amine?
The canonical SMILES for 3-cyclobutyl-3-methoxybutan-1-amine is COC(C)(CCN)C1CCC1.
What is the InChIKey of 3-cyclobutyl-3-methoxybutan-1-amine?
The InChIKey is BEXPROOQGFNJPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-9(11-2,6-7-10)8-4-3-5-8/h8H,3-7,10H2,1-2H3.
What are the key properties of 3-cyclobutyl-3-methoxybutan-1-amine?
3-cyclobutyl-3-methoxybutan-1-amine has a molecular weight of 157.26 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-3-methoxybutan-1-amine is sourced from PubChem (CID 105430822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).