3-(cyclopropylmethyl)-1-methylpyrrolidine

C9H17N — CID 127006990

IUPAC3-(cyclopropylmethyl)-1-methylpyrrolidine
SMILESCN1CCC(CC2CC2)C1
InChIInChI=1S/C9H17N/c1-10-5-4-9(7-10)6-8-2-3-8/h8-9H,2-7H2,1H3
InChIKeyQOGCSEVXWOUAEO-UHFFFAOYSA-N
MW139.24 g/mol
LogP1.74
Rot. Bonds2

About 3-(cyclopropylmethyl)-1-methylpyrrolidine

3-(cyclopropylmethyl)-1-methylpyrrolidine (PubChem CID 127006990) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 3-(cyclopropylmethyl)-1-methylpyrrolidine.

Molecular Properties

Compound Name3-(cyclopropylmethyl)-1-methylpyrrolidine
PubChem CID127006990
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name3-(cyclopropylmethyl)-1-methylpyrrolidine
SMILESCN1CCC(CC2CC2)C1
InChIInChI=1S/C9H17N/c1-10-5-4-9(7-10)6-8-2-3-8/h8-9H,2-7H2,1H3
InChIKeyQOGCSEVXWOUAEO-UHFFFAOYSA-N
XLogP1.74
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylmethyl)-1-methylpyrrolidine?
The IUPAC name of 3-(cyclopropylmethyl)-1-methylpyrrolidine (CID 127006990) is 3-(cyclopropylmethyl)-1-methylpyrrolidine.
What is the SMILES notation for 3-(cyclopropylmethyl)-1-methylpyrrolidine?
The canonical SMILES for 3-(cyclopropylmethyl)-1-methylpyrrolidine is CN1CCC(CC2CC2)C1.
What is the InChIKey of 3-(cyclopropylmethyl)-1-methylpyrrolidine?
The InChIKey is QOGCSEVXWOUAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-10-5-4-9(7-10)6-8-2-3-8/h8-9H,2-7H2,1H3.
What are the key properties of 3-(cyclopropylmethyl)-1-methylpyrrolidine?
3-(cyclopropylmethyl)-1-methylpyrrolidine has a molecular weight of 139.24 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethyl)-1-methylpyrrolidine is sourced from PubChem (CID 127006990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).