(3-methoxypyrrolidin-1-yl)methanamine

C6H14N2O — CID 166901786

IUPAC(3-methoxypyrrolidin-1-yl)methanamine
SMILESCOC1CCN(CN)C1
InChIInChI=1S/C6H14N2O/c1-9-6-2-3-8(4-6)5-7/h6H,2-5,7H2,1H3
InChIKeySNQJSFQVGVPVMC-UHFFFAOYSA-N
MW130.19 g/mol
LogP-0.38
Rot. Bonds2

About (3-methoxypyrrolidin-1-yl)methanamine

(3-methoxypyrrolidin-1-yl)methanamine (PubChem CID 166901786) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is (3-methoxypyrrolidin-1-yl)methanamine.

Molecular Properties

Compound Name(3-methoxypyrrolidin-1-yl)methanamine
PubChem CID166901786
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Name(3-methoxypyrrolidin-1-yl)methanamine
SMILESCOC1CCN(CN)C1
InChIInChI=1S/C6H14N2O/c1-9-6-2-3-8(4-6)5-7/h6H,2-5,7H2,1H3
InChIKeySNQJSFQVGVPVMC-UHFFFAOYSA-N
XLogP-0.38
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-methoxypyrrolidin-1-yl)methanamine?
The IUPAC name of (3-methoxypyrrolidin-1-yl)methanamine (CID 166901786) is (3-methoxypyrrolidin-1-yl)methanamine.
What is the SMILES notation for (3-methoxypyrrolidin-1-yl)methanamine?
The canonical SMILES for (3-methoxypyrrolidin-1-yl)methanamine is COC1CCN(CN)C1.
What is the InChIKey of (3-methoxypyrrolidin-1-yl)methanamine?
The InChIKey is SNQJSFQVGVPVMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-9-6-2-3-8(4-6)5-7/h6H,2-5,7H2,1H3.
What are the key properties of (3-methoxypyrrolidin-1-yl)methanamine?
(3-methoxypyrrolidin-1-yl)methanamine has a molecular weight of 130.19 g/mol, XLogP of -0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxypyrrolidin-1-yl)methanamine is sourced from PubChem (CID 166901786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).