2-(2-cyclopropylethoxy)-3-methylbutan-1-amine

C10H21NO — CID 106205725

IUPAC2-(2-cyclopropylethoxy)-3-methylbutan-1-amine
SMILESCC(C)C(CN)OCCC1CC1
InChIInChI=1S/C10H21NO/c1-8(2)10(7-11)12-6-5-9-3-4-9/h8-10H,3-7,11H2,1-2H3
InChIKeyUERRHGDEXOZPNP-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.79
Rot. Bonds6

About 2-(2-cyclopropylethoxy)-3-methylbutan-1-amine

2-(2-cyclopropylethoxy)-3-methylbutan-1-amine (PubChem CID 106205725) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 2-(2-cyclopropylethoxy)-3-methylbutan-1-amine.

Molecular Properties

Compound Name2-(2-cyclopropylethoxy)-3-methylbutan-1-amine
PubChem CID106205725
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name2-(2-cyclopropylethoxy)-3-methylbutan-1-amine
SMILESCC(C)C(CN)OCCC1CC1
InChIInChI=1S/C10H21NO/c1-8(2)10(7-11)12-6-5-9-3-4-9/h8-10H,3-7,11H2,1-2H3
InChIKeyUERRHGDEXOZPNP-UHFFFAOYSA-N
XLogP1.79
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylethoxy)-3-methylbutan-1-amine?
The IUPAC name of 2-(2-cyclopropylethoxy)-3-methylbutan-1-amine (CID 106205725) is 2-(2-cyclopropylethoxy)-3-methylbutan-1-amine.
What is the SMILES notation for 2-(2-cyclopropylethoxy)-3-methylbutan-1-amine?
The canonical SMILES for 2-(2-cyclopropylethoxy)-3-methylbutan-1-amine is CC(C)C(CN)OCCC1CC1.
What is the InChIKey of 2-(2-cyclopropylethoxy)-3-methylbutan-1-amine?
The InChIKey is UERRHGDEXOZPNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-8(2)10(7-11)12-6-5-9-3-4-9/h8-10H,3-7,11H2,1-2H3.
What are the key properties of 2-(2-cyclopropylethoxy)-3-methylbutan-1-amine?
2-(2-cyclopropylethoxy)-3-methylbutan-1-amine has a molecular weight of 171.28 g/mol, XLogP of 1.79, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylethoxy)-3-methylbutan-1-amine is sourced from PubChem (CID 106205725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).