N-(piperidin-4-ylmethyl)pentan-1-amine

C11H24N2 — CID 44592949

IUPACN-(piperidin-4-ylmethyl)pentan-1-amine
SMILESCCCCCNCC1CCNCC1
InChIInChI=1S/C11H24N2/c1-2-3-4-7-13-10-11-5-8-12-9-6-11/h11-13H,2-10H2,1H3
InChIKeyTVGHLVCDGIXZCO-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.77
Rot. Bonds6

About N-(piperidin-4-ylmethyl)pentan-1-amine

N-(piperidin-4-ylmethyl)pentan-1-amine (PubChem CID 44592949) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-(piperidin-4-ylmethyl)pentan-1-amine.

Molecular Properties

Compound NameN-(piperidin-4-ylmethyl)pentan-1-amine
PubChem CID44592949
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-(piperidin-4-ylmethyl)pentan-1-amine
SMILESCCCCCNCC1CCNCC1
InChIInChI=1S/C11H24N2/c1-2-3-4-7-13-10-11-5-8-12-9-6-11/h11-13H,2-10H2,1H3
InChIKeyTVGHLVCDGIXZCO-UHFFFAOYSA-N
XLogP1.77
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.77
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-(piperidin-4-ylmethyl)pentan-1-amine?
The IUPAC name of N-(piperidin-4-ylmethyl)pentan-1-amine (CID 44592949) is N-(piperidin-4-ylmethyl)pentan-1-amine.
What is the SMILES notation for N-(piperidin-4-ylmethyl)pentan-1-amine?
The canonical SMILES for N-(piperidin-4-ylmethyl)pentan-1-amine is CCCCCNCC1CCNCC1.
What is the InChIKey of N-(piperidin-4-ylmethyl)pentan-1-amine?
The InChIKey is TVGHLVCDGIXZCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-2-3-4-7-13-10-11-5-8-12-9-6-11/h11-13H,2-10H2,1H3.
What are the key properties of N-(piperidin-4-ylmethyl)pentan-1-amine?
N-(piperidin-4-ylmethyl)pentan-1-amine has a molecular weight of 184.33 g/mol, XLogP of 1.77, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-4-ylmethyl)pentan-1-amine is sourced from PubChem (CID 44592949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).