1-tetradecylpiperidine;hydrochloride

C19H40ClN — CID 71325293

IUPAC1-tetradecylpiperidine;hydrochloride
SMILESCCCCCCCCCCCCCCN1CCCCC1.Cl
InChIInChI=1S/C19H39N.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-20-18-15-13-16-19-20;/h2-19H2,1H3;1H
InChIKeyGXYFSACZVMBZPE-UHFFFAOYSA-N
MW317.99 g/mol
LogP6.60
Rot. Bonds13

About 1-tetradecylpiperidine;hydrochloride

1-tetradecylpiperidine;hydrochloride (PubChem CID 71325293) has the molecular formula C19H40ClN and a molecular weight of 317.99 g/mol. Its IUPAC name is 1-tetradecylpiperidine;hydrochloride.

Molecular Properties

Compound Name1-tetradecylpiperidine;hydrochloride
PubChem CID71325293
Molecular FormulaC19H40ClN
Molecular Weight317.99 g/mol
Exact Mass317.28
IUPAC Name1-tetradecylpiperidine;hydrochloride
SMILESCCCCCCCCCCCCCCN1CCCCC1.Cl
InChIInChI=1S/C19H39N.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-20-18-15-13-16-19-20;/h2-19H2,1H3;1H
InChIKeyGXYFSACZVMBZPE-UHFFFAOYSA-N
XLogP6.60
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500317.99
LogP ≤ 56.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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
CID 162323144
CID 162323144
ethane;1-nonylpiperidine
CID 177011009
1-butylpiperidine;hexane;1-hexylpiperidine
CID 156727490
1-heptylazetidine
CID 134402356
1-tridecylpiperidine tetrafluoroborate
CID 174702126
1,4,7,10-tetraheptyl-1,4,7,10-tetrazacyclotridecane
CID 24824731
acetic acid;1-nonylpiperidine
CID 175874764
1-octylaziridine
CID 544653
1,4,7-tridodecyl-1,4,7-triazonane
CID 66887116

Frequently Asked Questions

What is the IUPAC name of 1-tetradecylpiperidine;hydrochloride?
The IUPAC name of 1-tetradecylpiperidine;hydrochloride (CID 71325293) is 1-tetradecylpiperidine;hydrochloride.
What is the SMILES notation for 1-tetradecylpiperidine;hydrochloride?
The canonical SMILES for 1-tetradecylpiperidine;hydrochloride is CCCCCCCCCCCCCCN1CCCCC1.Cl.
What is the InChIKey of 1-tetradecylpiperidine;hydrochloride?
The InChIKey is GXYFSACZVMBZPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39N.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-20-18-15-13-16-19-20;/h2-19H2,1H3;1H.
What are the key properties of 1-tetradecylpiperidine;hydrochloride?
1-tetradecylpiperidine;hydrochloride has a molecular weight of 317.99 g/mol, XLogP of 6.60, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tetradecylpiperidine;hydrochloride is sourced from PubChem (CID 71325293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).