N-butyl-N-(5-piperidin-1-ylpentyl)propanamide

C17H34N2O — CID 142122170

IUPACN-butyl-N-(5-piperidin-1-ylpentyl)propanamide
SMILESCCCCN(CCCCCN1CCCCC1)C(=O)CC
InChIInChI=1S/C17H34N2O/c1-3-5-15-19(17(20)4-2)16-11-7-10-14-18-12-8-6-9-13-18/h3-16H2,1-2H3
InChIKeyQVAPPAZWBMZCGW-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.68
Rot. Bonds10

About N-butyl-N-(5-piperidin-1-ylpentyl)propanamide

N-butyl-N-(5-piperidin-1-ylpentyl)propanamide (PubChem CID 142122170) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is N-butyl-N-(5-piperidin-1-ylpentyl)propanamide.

Molecular Properties

Compound NameN-butyl-N-(5-piperidin-1-ylpentyl)propanamide
PubChem CID142122170
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC NameN-butyl-N-(5-piperidin-1-ylpentyl)propanamide
SMILESCCCCN(CCCCCN1CCCCC1)C(=O)CC
InChIInChI=1S/C17H34N2O/c1-3-5-15-19(17(20)4-2)16-11-7-10-14-18-12-8-6-9-13-18/h3-16H2,1-2H3
InChIKeyQVAPPAZWBMZCGW-UHFFFAOYSA-N
XLogP3.68
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-decylpiperidine
CID 4649960
1-octylazonane
CID 20533821
1-dodecylazepane
CID 3366129
acetic acid;1-nonylpiperidine
CID 175874764
1-tetradecylpiperidine;hydrochloride
CID 71325293
CID 162323144
CID 162323144
ethane;1-nonylpiperidine
CID 177011009
1-butylpiperidine;hexane;1-hexylpiperidine
CID 156727490
N-[3-(dibutylamino)propyl]-N-octadecylpropanamide
CID 146463655
acetic acid;1-dodecylpyrrolidine
CID 175583827
N-butyl-N-(2-chloroethyl)propanamide
CID 63390792
N-butyl-3,3-dimethyl-N-(5-morpholin-4-ylpentyl)butanamide
CID 58848463

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-(5-piperidin-1-ylpentyl)propanamide?
The IUPAC name of N-butyl-N-(5-piperidin-1-ylpentyl)propanamide (CID 142122170) is N-butyl-N-(5-piperidin-1-ylpentyl)propanamide.
What is the SMILES notation for N-butyl-N-(5-piperidin-1-ylpentyl)propanamide?
The canonical SMILES for N-butyl-N-(5-piperidin-1-ylpentyl)propanamide is CCCCN(CCCCCN1CCCCC1)C(=O)CC.
What is the InChIKey of N-butyl-N-(5-piperidin-1-ylpentyl)propanamide?
The InChIKey is QVAPPAZWBMZCGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-3-5-15-19(17(20)4-2)16-11-7-10-14-18-12-8-6-9-13-18/h3-16H2,1-2H3.
What are the key properties of N-butyl-N-(5-piperidin-1-ylpentyl)propanamide?
N-butyl-N-(5-piperidin-1-ylpentyl)propanamide has a molecular weight of 282.47 g/mol, XLogP of 3.68, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-(5-piperidin-1-ylpentyl)propanamide is sourced from PubChem (CID 142122170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).