N-ethyl-3-piperidin-4-ylpropan-1-amine

C10H22N2 — CID 62212185

IUPACN-ethyl-3-piperidin-4-ylpropan-1-amine
SMILESCCNCCCC1CCNCC1
InChIInChI=1S/C10H22N2/c1-2-11-7-3-4-10-5-8-12-9-6-10/h10-12H,2-9H2,1H3
InChIKeyPITIDLARLFISKV-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.38
Rot. Bonds5

About N-ethyl-3-piperidin-4-ylpropan-1-amine

N-ethyl-3-piperidin-4-ylpropan-1-amine (PubChem CID 62212185) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N-ethyl-3-piperidin-4-ylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-piperidin-4-ylpropan-1-amine
PubChem CID62212185
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN-ethyl-3-piperidin-4-ylpropan-1-amine
SMILESCCNCCCC1CCNCC1
InChIInChI=1S/C10H22N2/c1-2-11-7-3-4-10-5-8-12-9-6-10/h10-12H,2-9H2,1H3
InChIKeyPITIDLARLFISKV-UHFFFAOYSA-N
XLogP1.38
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.38
H-Bond Donors ≤ 52
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 N-ethyl-3-piperidin-4-ylpropan-1-amine?
The IUPAC name of N-ethyl-3-piperidin-4-ylpropan-1-amine (CID 62212185) is N-ethyl-3-piperidin-4-ylpropan-1-amine.
What is the SMILES notation for N-ethyl-3-piperidin-4-ylpropan-1-amine?
The canonical SMILES for N-ethyl-3-piperidin-4-ylpropan-1-amine is CCNCCCC1CCNCC1.
What is the InChIKey of N-ethyl-3-piperidin-4-ylpropan-1-amine?
The InChIKey is PITIDLARLFISKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-2-11-7-3-4-10-5-8-12-9-6-10/h10-12H,2-9H2,1H3.
What are the key properties of N-ethyl-3-piperidin-4-ylpropan-1-amine?
N-ethyl-3-piperidin-4-ylpropan-1-amine has a molecular weight of 170.30 g/mol, XLogP of 1.38, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-piperidin-4-ylpropan-1-amine is sourced from PubChem (CID 62212185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).