piperidine-1-carboxylic acid;styrene

C14H19NO2 — CID 174300067

IUPACpiperidine-1-carboxylic acid;styrene
SMILESC=Cc1ccccc1.O=C(O)N1CCCCC1
InChIInChI=1S/C8H8.C6H11NO2/c1-2-8-6-4-3-5-7-8;8-6(9)7-4-2-1-3-5-7/h2-7H,1H2;1-5H2,(H,8,9)
InChIKeyXEGJQRCZVYPXRC-UHFFFAOYSA-N
MW233.31 g/mol
LogP3.48
Rot. Bonds1

About piperidine-1-carboxylic acid;styrene

piperidine-1-carboxylic acid;styrene (PubChem CID 174300067) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is piperidine-1-carboxylic acid;styrene.

Molecular Properties

Compound Namepiperidine-1-carboxylic acid;styrene
PubChem CID174300067
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Namepiperidine-1-carboxylic acid;styrene
SMILESC=Cc1ccccc1.O=C(O)N1CCCCC1
InChIInChI=1S/C8H8.C6H11NO2/c1-2-8-6-4-3-5-7-8;8-6(9)7-4-2-1-3-5-7/h2-7H,1H2;1-5H2,(H,8,9)
InChIKeyXEGJQRCZVYPXRC-UHFFFAOYSA-N
XLogP3.48
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of piperidine-1-carboxylic acid;styrene?
The IUPAC name of piperidine-1-carboxylic acid;styrene (CID 174300067) is piperidine-1-carboxylic acid;styrene.
What is the SMILES notation for piperidine-1-carboxylic acid;styrene?
The canonical SMILES for piperidine-1-carboxylic acid;styrene is C=Cc1ccccc1.O=C(O)N1CCCCC1.
What is the InChIKey of piperidine-1-carboxylic acid;styrene?
The InChIKey is XEGJQRCZVYPXRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8.C6H11NO2/c1-2-8-6-4-3-5-7-8;8-6(9)7-4-2-1-3-5-7/h2-7H,1H2;1-5H2,(H,8,9).
What are the key properties of piperidine-1-carboxylic acid;styrene?
piperidine-1-carboxylic acid;styrene has a molecular weight of 233.31 g/mol, XLogP of 3.48, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for piperidine-1-carboxylic acid;styrene is sourced from PubChem (CID 174300067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).