1-(1-methoxypropyl)pyrrolidine

C8H17NO — CID 57003062

IUPAC1-(1-methoxypropyl)pyrrolidine
SMILESCCC(OC)N1CCCC1
InChIInChI=1S/C8H17NO/c1-3-8(10-2)9-6-4-5-7-9/h8H,3-7H2,1-2H3
InChIKeyFMAIHXHNADXHLM-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.46
Rot. Bonds3

About 1-(1-methoxypropyl)pyrrolidine

1-(1-methoxypropyl)pyrrolidine (PubChem CID 57003062) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 1-(1-methoxypropyl)pyrrolidine.

Molecular Properties

Compound Name1-(1-methoxypropyl)pyrrolidine
PubChem CID57003062
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name1-(1-methoxypropyl)pyrrolidine
SMILESCCC(OC)N1CCCC1
InChIInChI=1S/C8H17NO/c1-3-8(10-2)9-6-4-5-7-9/h8H,3-7H2,1-2H3
InChIKeyFMAIHXHNADXHLM-UHFFFAOYSA-N
XLogP1.46
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxypropyl)pyrrolidine?
The IUPAC name of 1-(1-methoxypropyl)pyrrolidine (CID 57003062) is 1-(1-methoxypropyl)pyrrolidine.
What is the SMILES notation for 1-(1-methoxypropyl)pyrrolidine?
The canonical SMILES for 1-(1-methoxypropyl)pyrrolidine is CCC(OC)N1CCCC1.
What is the InChIKey of 1-(1-methoxypropyl)pyrrolidine?
The InChIKey is FMAIHXHNADXHLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-3-8(10-2)9-6-4-5-7-9/h8H,3-7H2,1-2H3.
What are the key properties of 1-(1-methoxypropyl)pyrrolidine?
1-(1-methoxypropyl)pyrrolidine has a molecular weight of 143.23 g/mol, XLogP of 1.46, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxypropyl)pyrrolidine is sourced from PubChem (CID 57003062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).