1-(1-phenylpentyl)pyrrolidine;hydrochloride

C15H24ClN — CID 3057979

IUPAC1-(1-phenylpentyl)pyrrolidine;hydrochloride
SMILESCCCCC(c1ccccc1)N1CCCC1.Cl
InChIInChI=1S/C15H23N.ClH/c1-2-3-11-15(16-12-7-8-13-16)14-9-5-4-6-10-14;/h4-6,9-10,15H,2-3,7-8,11-13H2,1H3;1H
InChIKeyBYUKWISULSTRFI-UHFFFAOYSA-N
MW253.82 g/mol
LogP4.44
Rot. Bonds5

About 1-(1-phenylpentyl)pyrrolidine;hydrochloride

1-(1-phenylpentyl)pyrrolidine;hydrochloride (PubChem CID 3057979) has the molecular formula C15H24ClN and a molecular weight of 253.82 g/mol. Its IUPAC name is 1-(1-phenylpentyl)pyrrolidine;hydrochloride.

Molecular Properties

Compound Name1-(1-phenylpentyl)pyrrolidine;hydrochloride
PubChem CID3057979
Molecular FormulaC15H24ClN
Molecular Weight253.82 g/mol
Exact Mass253.16
IUPAC Name1-(1-phenylpentyl)pyrrolidine;hydrochloride
SMILESCCCCC(c1ccccc1)N1CCCC1.Cl
InChIInChI=1S/C15H23N.ClH/c1-2-3-11-15(16-12-7-8-13-16)14-9-5-4-6-10-14;/h4-6,9-10,15H,2-3,7-8,11-13H2,1H3;1H
InChIKeyBYUKWISULSTRFI-UHFFFAOYSA-N
XLogP4.44
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 ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1-phenylpentyl)pyrrolidine;hydrochloride?
The IUPAC name of 1-(1-phenylpentyl)pyrrolidine;hydrochloride (CID 3057979) is 1-(1-phenylpentyl)pyrrolidine;hydrochloride.
What is the SMILES notation for 1-(1-phenylpentyl)pyrrolidine;hydrochloride?
The canonical SMILES for 1-(1-phenylpentyl)pyrrolidine;hydrochloride is CCCCC(c1ccccc1)N1CCCC1.Cl.
What is the InChIKey of 1-(1-phenylpentyl)pyrrolidine;hydrochloride?
The InChIKey is BYUKWISULSTRFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N.ClH/c1-2-3-11-15(16-12-7-8-13-16)14-9-5-4-6-10-14;/h4-6,9-10,15H,2-3,7-8,11-13H2,1H3;1H.
What are the key properties of 1-(1-phenylpentyl)pyrrolidine;hydrochloride?
1-(1-phenylpentyl)pyrrolidine;hydrochloride has a molecular weight of 253.82 g/mol, XLogP of 4.44, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenylpentyl)pyrrolidine;hydrochloride is sourced from PubChem (CID 3057979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).