1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine

C11H23NO — CID 116723219

IUPAC1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine
SMILESCCOC(C1CC1)C(N)C(C)(C)C
InChIInChI=1S/C11H23NO/c1-5-13-9(8-6-7-8)10(12)11(2,3)4/h8-10H,5-7,12H2,1-4H3
InChIKeySPFUITWASAPEDM-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.17
Rot. Bonds4

About 1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine

1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine (PubChem CID 116723219) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine
PubChem CID116723219
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine
SMILESCCOC(C1CC1)C(N)C(C)(C)C
InChIInChI=1S/C11H23NO/c1-5-13-9(8-6-7-8)10(12)11(2,3)4/h8-10H,5-7,12H2,1-4H3
InChIKeySPFUITWASAPEDM-UHFFFAOYSA-N
XLogP2.17
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-1-ethoxy-3-ethylpentan-2-amine
CID 116723204
1-cyclopropyl-1-ethoxynonan-2-amine
CID 116723047
1-cyclobutyl-2-cyclopropyl-2-ethoxyethanol
CID 116712819
1-cyclopropyl-1-ethoxy-N-methylbutan-2-amine
CID 116723276
1-cyclopropyl-1-ethoxy-3-methoxypropan-2-ol
CID 116712870
(1-cyclohexyl-2-cyclopropyl-2-ethoxyethyl)hydrazine
CID 105273087
2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol
CID 116712860
2-cyclopropyl-2-ethoxy-1-(furan-2-yl)ethanamine
CID 116723060
1-cyclohexyl-1-ethoxy-5-methylhexan-2-amine
CID 116771942
1-(5-chlorothiophen-2-yl)-2-cyclopropyl-2-ethoxyethanamine
CID 116723193
2-cyclopropyl-2-ethoxy-1-(5-methylthiophen-2-yl)ethanamine
CID 116723225
1-(cyclohexen-1-yl)-2-cyclopropyl-2-ethoxyethanamine
CID 106654499

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine?
The IUPAC name of 1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine (CID 116723219) is 1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine.
What is the SMILES notation for 1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine?
The canonical SMILES for 1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine is CCOC(C1CC1)C(N)C(C)(C)C.
What is the InChIKey of 1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine?
The InChIKey is SPFUITWASAPEDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-5-13-9(8-6-7-8)10(12)11(2,3)4/h8-10H,5-7,12H2,1-4H3.
What are the key properties of 1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine?
1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine has a molecular weight of 185.31 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-ethoxy-3,3-dimethylbutan-2-amine is sourced from PubChem (CID 116723219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).