N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide

C16H30N2O — CID 106011682

IUPACN-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide
SMILESO=C(CCC1CCCNC1)NCCCC1CCCC1
InChIInChI=1S/C16H30N2O/c19-16(10-9-15-8-3-11-17-13-15)18-12-4-7-14-5-1-2-6-14/h14-15,17H,1-13H2,(H,18,19)
InChIKeyFWJSISKRBCSHHM-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.85
Rot. Bonds7

About N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide

N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide (PubChem CID 106011682) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide.

Molecular Properties

Compound NameN-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide
PubChem CID106011682
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide
SMILESO=C(CCC1CCCNC1)NCCCC1CCCC1
InChIInChI=1S/C16H30N2O/c19-16(10-9-15-8-3-11-17-13-15)18-12-4-7-14-5-1-2-6-14/h14-15,17H,1-13H2,(H,18,19)
InChIKeyFWJSISKRBCSHHM-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.85
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-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide?
The IUPAC name of N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide (CID 106011682) is N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide.
What is the SMILES notation for N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide?
The canonical SMILES for N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide is O=C(CCC1CCCNC1)NCCCC1CCCC1.
What is the InChIKey of N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide?
The InChIKey is FWJSISKRBCSHHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c19-16(10-9-15-8-3-11-17-13-15)18-12-4-7-14-5-1-2-6-14/h14-15,17H,1-13H2,(H,18,19).
What are the key properties of N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide?
N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide has a molecular weight of 266.43 g/mol, XLogP of 2.85, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentylpropyl)-3-piperidin-3-ylpropanamide is sourced from PubChem (CID 106011682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).