4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine

C11H24N2O — CID 103152222

IUPAC4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine
SMILESCCC1CCCN1CCC(CN)OC
InChIInChI=1S/C11H24N2O/c1-3-10-5-4-7-13(10)8-6-11(9-12)14-2/h10-11H,3-9,12H2,1-2H3
InChIKeyRQXHUQPTFUHBCY-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.22
Rot. Bonds6

About 4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine

4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine (PubChem CID 103152222) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine.

Molecular Properties

Compound Name4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine
PubChem CID103152222
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine
SMILESCCC1CCCN1CCC(CN)OC
InChIInChI=1S/C11H24N2O/c1-3-10-5-4-7-13(10)8-6-11(9-12)14-2/h10-11H,3-9,12H2,1-2H3
InChIKeyRQXHUQPTFUHBCY-UHFFFAOYSA-N
XLogP1.22
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-methoxybutan-1-amine
CID 103152610
5-(2-ethylpyrrolidin-1-yl)-2-methylpentan-1-amine
CID 82682659
2-ethoxy-4-(2-propylpiperidin-1-yl)butan-1-amine
CID 83052818
4-(2,3-dimethylpiperidin-1-yl)-2-ethoxybutan-1-amine
CID 63069725
5-(2-ethylpiperidin-1-yl)-2-methylpentan-1-amine
CID 82016951
2-[2-(2-ethylazepan-1-yl)ethyl]-4-methylpentan-1-amine
CID 113441769
2-ethyl-1-propylpyrrolidine;hydrochloride
CID 175875106
1-(2-ethylazepan-1-yl)-4-methoxy-4-methylpentan-3-amine
CID 114229188
2-ethoxy-3-(2-ethylazepan-1-yl)propan-1-amine
CID 104689096
2-methoxy-3-(2-propylpiperidin-1-yl)propan-1-amine
CID 106114983
[(2R)-1-(3-methylbutyl)pyrrolidin-2-yl]methanamine
CID 93497649
2-ethyl-2-[(2-ethylpyrrolidin-1-yl)methyl]butan-1-amine
CID 62278340

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine?
The IUPAC name of 4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine (CID 103152222) is 4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine.
What is the SMILES notation for 4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine?
The canonical SMILES for 4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine is CCC1CCCN1CCC(CN)OC.
What is the InChIKey of 4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine?
The InChIKey is RQXHUQPTFUHBCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-3-10-5-4-7-13(10)8-6-11(9-12)14-2/h10-11H,3-9,12H2,1-2H3.
What are the key properties of 4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine?
4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine has a molecular weight of 200.33 g/mol, XLogP of 1.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylpyrrolidin-1-yl)-2-methoxybutan-1-amine is sourced from PubChem (CID 103152222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).