N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine

C11H22N2 — CID 106976265

IUPACN-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine
SMILESCCCC1(CNC2CC2)CCCN1
InChIInChI=1S/C11H22N2/c1-2-6-11(7-3-8-13-11)9-12-10-4-5-10/h10,12-13H,2-9H2,1H3
InChIKeyOUCTXLNDWJKKLO-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.66
Rot. Bonds5

About N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine

N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine (PubChem CID 106976265) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine
PubChem CID106976265
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC NameN-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine
SMILESCCCC1(CNC2CC2)CCCN1
InChIInChI=1S/C11H22N2/c1-2-6-11(7-3-8-13-11)9-12-10-4-5-10/h10,12-13H,2-9H2,1H3
InChIKeyOUCTXLNDWJKKLO-UHFFFAOYSA-N
XLogP1.66
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine (CID 106976265) is N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine is CCCC1(CNC2CC2)CCCN1.
What is the InChIKey of N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine?
The InChIKey is OUCTXLNDWJKKLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-2-6-11(7-3-8-13-11)9-12-10-4-5-10/h10,12-13H,2-9H2,1H3.
What are the key properties of N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine?
N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine has a molecular weight of 182.31 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine is sourced from PubChem (CID 106976265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).