5-pyrrolidin-1-ylpentan-1-amine

C9H20N2 — CID 7019182

IUPAC5-pyrrolidin-1-ylpentan-1-amine
SMILESNCCCCCN1CCCC1
InChIInChI=1S/C9H20N2/c10-6-2-1-3-7-11-8-4-5-9-11/h1-10H2
InChIKeyWGARYFRHBPNMCZ-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.21
Rot. Bonds5

About 5-pyrrolidin-1-ylpentan-1-amine

5-pyrrolidin-1-ylpentan-1-amine (PubChem CID 7019182) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 5-pyrrolidin-1-ylpentan-1-amine.

Molecular Properties

Compound Name5-pyrrolidin-1-ylpentan-1-amine
PubChem CID7019182
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name5-pyrrolidin-1-ylpentan-1-amine
SMILESNCCCCCN1CCCC1
InChIInChI=1S/C9H20N2/c10-6-2-1-3-7-11-8-4-5-9-11/h1-10H2
InChIKeyWGARYFRHBPNMCZ-UHFFFAOYSA-N
XLogP1.21
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-pyrrolidin-1-ylpentan-1-amine?
The IUPAC name of 5-pyrrolidin-1-ylpentan-1-amine (CID 7019182) is 5-pyrrolidin-1-ylpentan-1-amine.
What is the SMILES notation for 5-pyrrolidin-1-ylpentan-1-amine?
The canonical SMILES for 5-pyrrolidin-1-ylpentan-1-amine is NCCCCCN1CCCC1.
What is the InChIKey of 5-pyrrolidin-1-ylpentan-1-amine?
The InChIKey is WGARYFRHBPNMCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c10-6-2-1-3-7-11-8-4-5-9-11/h1-10H2.
What are the key properties of 5-pyrrolidin-1-ylpentan-1-amine?
5-pyrrolidin-1-ylpentan-1-amine has a molecular weight of 156.27 g/mol, XLogP of 1.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrrolidin-1-ylpentan-1-amine is sourced from PubChem (CID 7019182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).