3-(Methoxymethyl)pyrrolidin-1-amine

C6H14N2O — CID 80034233

IUPAC3-(methoxymethyl)pyrrolidin-1-amine
SMILESCOCC1CCN(C1)N
InChIInChI=1S/C6H14N2O/c1-9-5-6-2-3-8(7)4-6/h6H,2-5,7H2,1H3
InChIKeyANWJWUBZWNQFNA-UHFFFAOYSA-N
MW130.19 g/mol
LogP-0.20
Rot. Bonds2

About 3-(Methoxymethyl)pyrrolidin-1-amine

3-(Methoxymethyl)pyrrolidin-1-amine (PubChem CID 80034233) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is 3-(methoxymethyl)pyrrolidin-1-amine.

Molecular Properties

Compound Name3-(Methoxymethyl)pyrrolidin-1-amine
PubChem CID80034233
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Name3-(methoxymethyl)pyrrolidin-1-amine
SMILESCOCC1CCN(C1)N
InChIInChI=1S/C6H14N2O/c1-9-5-6-2-3-8(7)4-6/h6H,2-5,7H2,1H3
InChIKeyANWJWUBZWNQFNA-UHFFFAOYSA-N
XLogP-0.20
TPSA38.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity87

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-0.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

(+/-)2-Methoxypyrrolidin-1-amine
CID 67193307
3-(Methoxymethyl)-4-(trifluoromethyl)pyrrolidin-1-amine
CID 121202693
3-(Ethoxymethyl)-4-(trifluoromethyl)pyrrolidin-1-amine
CID 121202702
(3S,4R)-3-(ethoxymethyl)-4-(trifluoromethyl)pyrrolidin-1-amine
CID 129497379
(3S,4S)-3-(ethoxymethyl)-4-(trifluoromethyl)pyrrolidin-1-amine
CID 129497380
(3R,4S)-3-(ethoxymethyl)-4-(trifluoromethyl)pyrrolidin-1-amine
CID 129497381
(3R,4R)-3-(ethoxymethyl)-4-(trifluoromethyl)pyrrolidin-1-amine
CID 129497383
(3S,4S)-3-(methoxymethyl)-4-(trifluoromethyl)pyrrolidin-1-amine
CID 129498940
(3R,4S)-3-(methoxymethyl)-4-(trifluoromethyl)pyrrolidin-1-amine
CID 129498946
(3R,4R)-3-(methoxymethyl)-4-(trifluoromethyl)pyrrolidin-1-amine
CID 129498948
(3S,4R)-3-(methoxymethyl)-4-(trifluoromethyl)pyrrolidin-1-amine
CID 129498951
(1-Aminopyrrolidin-3-yl)methanol
CID 18985369

Frequently Asked Questions

What is the IUPAC name of 3-(Methoxymethyl)pyrrolidin-1-amine?
The IUPAC name of 3-(Methoxymethyl)pyrrolidin-1-amine (CID 80034233) is 3-(methoxymethyl)pyrrolidin-1-amine.
What is the SMILES notation for 3-(Methoxymethyl)pyrrolidin-1-amine?
The canonical SMILES for 3-(Methoxymethyl)pyrrolidin-1-amine is COCC1CCN(C1)N.
What is the InChIKey of 3-(Methoxymethyl)pyrrolidin-1-amine?
The InChIKey is ANWJWUBZWNQFNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-9-5-6-2-3-8(7)4-6/h6H,2-5,7H2,1H3.
What are the key properties of 3-(Methoxymethyl)pyrrolidin-1-amine?
3-(Methoxymethyl)pyrrolidin-1-amine has a molecular weight of 130.19 g/mol, XLogP of -0.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(Methoxymethyl)pyrrolidin-1-amine is sourced from PubChem (CID 80034233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).