piperidin-1-amine

C5H12N2 — CID 16658

IUPACpiperidin-1-amine
SMILESNN1CCCCC1
InChIInChI=1S/C5H12N2/c6-7-4-2-1-3-5-7/h1-6H2
InChIKeyLWMPFIOTEAXAGV-UHFFFAOYSA-N
MW100.17 g/mol
LogP0.35
Rot. Bonds

About piperidin-1-amine

piperidin-1-amine (PubChem CID 16658) has the molecular formula C5H12N2 and a molecular weight of 100.17 g/mol. Its IUPAC name is piperidin-1-amine.

Molecular Properties

Compound Namepiperidin-1-amine
PubChem CID16658
Molecular FormulaC5H12N2
Molecular Weight100.17 g/mol
Exact Mass100.10
IUPAC Namepiperidin-1-amine
SMILESNN1CCCCC1
InChIInChI=1S/C5H12N2/c6-7-4-2-1-3-5-7/h1-6H2
InChIKeyLWMPFIOTEAXAGV-UHFFFAOYSA-N
XLogP0.35
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.17
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of piperidin-1-amine?
The IUPAC name of piperidin-1-amine (CID 16658) is piperidin-1-amine.
What is the SMILES notation for piperidin-1-amine?
The canonical SMILES for piperidin-1-amine is NN1CCCCC1.
What is the InChIKey of piperidin-1-amine?
The InChIKey is LWMPFIOTEAXAGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c6-7-4-2-1-3-5-7/h1-6H2.
What are the key properties of piperidin-1-amine?
piperidin-1-amine has a molecular weight of 100.17 g/mol, XLogP of 0.35, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-1-amine is sourced from PubChem (CID 16658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).