[1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine

C8H18N2O — CID 43187013

IUPAC[1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine
SMILESCOCCN1CCCC1CN
InChIInChI=1S/C8H18N2O/c1-11-6-5-10-4-2-3-8(10)7-9/h8H,2-7,9H2,1H3
InChIKeyZYIDBOZXSPLZTK-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.06
Rot. Bonds4

About [1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine

[1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine (PubChem CID 43187013) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is [1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine
PubChem CID43187013
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name[1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine
SMILESCOCCN1CCCC1CN
InChIInChI=1S/C8H18N2O/c1-11-6-5-10-4-2-3-8(10)7-9/h8H,2-7,9H2,1H3
InChIKeyZYIDBOZXSPLZTK-UHFFFAOYSA-N
XLogP0.06
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine?
The IUPAC name of [1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine (CID 43187013) is [1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine.
What is the SMILES notation for [1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine?
The canonical SMILES for [1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine is COCCN1CCCC1CN.
What is the InChIKey of [1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine?
The InChIKey is ZYIDBOZXSPLZTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-11-6-5-10-4-2-3-8(10)7-9/h8H,2-7,9H2,1H3.
What are the key properties of [1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine?
[1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine has a molecular weight of 158.24 g/mol, XLogP of 0.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methoxyethyl)pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 43187013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).