1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine

C9H18N2 — CID 11970587

IUPAC1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine
SMILESC1CNC(CNCC2CC2)C1
InChIInChI=1S/C9H18N2/c1-2-9(11-5-1)7-10-6-8-3-4-8/h8-11H,1-7H2
InChIKeyNRUNYHTXLPOHDF-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.74
Rot. Bonds4

About 1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine

1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine (PubChem CID 11970587) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine
PubChem CID11970587
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine
SMILESC1CNC(CNCC2CC2)C1
InChIInChI=1S/C9H18N2/c1-2-9(11-5-1)7-10-6-8-3-4-8/h8-11H,1-7H2
InChIKeyNRUNYHTXLPOHDF-UHFFFAOYSA-N
XLogP0.74
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine?
The IUPAC name of 1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine (CID 11970587) is 1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine.
What is the SMILES notation for 1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine?
The canonical SMILES for 1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine is C1CNC(CNCC2CC2)C1.
What is the InChIKey of 1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine?
The InChIKey is NRUNYHTXLPOHDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-2-9(11-5-1)7-10-6-8-3-4-8/h8-11H,1-7H2.
What are the key properties of 1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine?
1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine has a molecular weight of 154.26 g/mol, XLogP of 0.74, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)methanamine is sourced from PubChem (CID 11970587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).