1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride

C15H24ClN — CID 14591

IUPAC1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride
SMILESCCCC(Cc1ccccc1)N1CCCC1.Cl
InChIInChI=1S/C15H23N.ClH/c1-2-8-15(16-11-6-7-12-16)13-14-9-4-3-5-10-14;/h3-5,9-10,15H,2,6-8,11-13H2,1H3;1H
InChIKeyFKOFBBOQSMUYHD-UHFFFAOYSA-N
MW253.82 g/mol
LogP3.92
Rot. Bonds5

About 1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride

1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride (PubChem CID 14591) has the molecular formula C15H24ClN and a molecular weight of 253.82 g/mol. Its IUPAC name is 1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride.

Molecular Properties

Compound Name1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride
PubChem CID14591
Molecular FormulaC15H24ClN
Molecular Weight253.82 g/mol
Exact Mass253.16
IUPAC Name1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride
SMILESCCCC(Cc1ccccc1)N1CCCC1.Cl
InChIInChI=1S/C15H23N.ClH/c1-2-8-15(16-11-6-7-12-16)13-14-9-4-3-5-10-14;/h3-5,9-10,15H,2,6-8,11-13H2,1H3;1H
InChIKeyFKOFBBOQSMUYHD-UHFFFAOYSA-N
XLogP3.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.82
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride?
The IUPAC name of 1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride (CID 14591) is 1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride.
What is the SMILES notation for 1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride?
The canonical SMILES for 1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride is CCCC(Cc1ccccc1)N1CCCC1.Cl.
What is the InChIKey of 1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride?
The InChIKey is FKOFBBOQSMUYHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N.ClH/c1-2-8-15(16-11-6-7-12-16)13-14-9-4-3-5-10-14;/h3-5,9-10,15H,2,6-8,11-13H2,1H3;1H.
What are the key properties of 1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride?
1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride has a molecular weight of 253.82 g/mol, XLogP of 3.92, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenylpentan-2-yl)pyrrolidine;hydrochloride is sourced from PubChem (CID 14591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).