4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine

C11H24N2O — CID 64705792

IUPAC4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine
SMILESCOCC1CCN(C(C)CC(C)N)C1
InChIInChI=1S/C11H24N2O/c1-9(12)6-10(2)13-5-4-11(7-13)8-14-3/h9-11H,4-8,12H2,1-3H3
InChIKeyYSHTUPIYRYIBHK-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.08
Rot. Bonds5

About 4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine

4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine (PubChem CID 64705792) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine.

Molecular Properties

Compound Name4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine
PubChem CID64705792
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine
SMILESCOCC1CCN(C(C)CC(C)N)C1
InChIInChI=1S/C11H24N2O/c1-9(12)6-10(2)13-5-4-11(7-13)8-14-3/h9-11H,4-8,12H2,1-3H3
InChIKeyYSHTUPIYRYIBHK-UHFFFAOYSA-N
XLogP1.08
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-(methoxymethyl)piperidin-1-yl]butan-1-amine
CID 63971694
N'-hydroxy-3-[3-(methoxymethyl)pyrrolidin-1-yl]butanimidamide
CID 77048476
3-[4-(methoxymethyl)piperidin-1-yl]butan-2-amine
CID 63974033
3-[3-(methoxymethyl)pyrrolidin-1-yl]butanimidamide
CID 64599754
3-methoxy-2-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-amine
CID 103226769
methyl 3-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylbutanoate
CID 79414057
2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-amine
CID 64569900
3-amino-4-methoxy-2-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol
CID 114357377
3-amino-2-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-1-ol
CID 104840464
5-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine
CID 64570689
N-ethyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]butan-2-amine
CID 64569697
2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine
CID 114802612

Frequently Asked Questions

What is the IUPAC name of 4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine?
The IUPAC name of 4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine (CID 64705792) is 4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine.
What is the SMILES notation for 4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine?
The canonical SMILES for 4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine is COCC1CCN(C(C)CC(C)N)C1.
What is the InChIKey of 4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine?
The InChIKey is YSHTUPIYRYIBHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-9(12)6-10(2)13-5-4-11(7-13)8-14-3/h9-11H,4-8,12H2,1-3H3.
What are the key properties of 4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine?
4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine has a molecular weight of 200.33 g/mol, XLogP of 1.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine is sourced from PubChem (CID 64705792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).