cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine

C9H18N2 — CID 20763726

IUPACcyclopropyl-(1-methylpyrrolidin-3-yl)methanamine
SMILESCN1CCC(C(N)C2CC2)C1
InChIInChI=1S/C9H18N2/c1-11-5-4-8(6-11)9(10)7-2-3-7/h7-9H,2-6,10H2,1H3
InChIKeyLFJDKFDSESNPQX-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.68
Rot. Bonds2

About cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine

cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine (PubChem CID 20763726) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine.

Molecular Properties

Compound Namecyclopropyl-(1-methylpyrrolidin-3-yl)methanamine
PubChem CID20763726
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Namecyclopropyl-(1-methylpyrrolidin-3-yl)methanamine
SMILESCN1CCC(C(N)C2CC2)C1
InChIInChI=1S/C9H18N2/c1-11-5-4-8(6-11)9(10)7-2-3-7/h7-9H,2-6,10H2,1H3
InChIKeyLFJDKFDSESNPQX-UHFFFAOYSA-N
XLogP0.68
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine?
The IUPAC name of cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine (CID 20763726) is cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine.
What is the SMILES notation for cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine?
The canonical SMILES for cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine is CN1CCC(C(N)C2CC2)C1.
What is the InChIKey of cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine?
The InChIKey is LFJDKFDSESNPQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-11-5-4-8(6-11)9(10)7-2-3-7/h7-9H,2-6,10H2,1H3.
What are the key properties of cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine?
cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine has a molecular weight of 154.26 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(1-methylpyrrolidin-3-yl)methanamine is sourced from PubChem (CID 20763726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).