1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride

C24H26ClN — CID 3046625

IUPAC1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride
SMILESCl.c1ccc(C(CCN2CCCc3ccccc32)c2ccccc2)cc1
InChIInChI=1S/C24H25N.ClH/c1-3-10-20(11-4-1)23(21-12-5-2-6-13-21)17-19-25-18-9-15-22-14-7-8-16-24(22)25;/h1-8,10-14,16,23H,9,15,17-19H2;1H
InChIKeyBMEYEEORIOJREQ-UHFFFAOYSA-N
MW363.93 g/mol
LogP6.08
Rot. Bonds5

About 1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride

1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride (PubChem CID 3046625) has the molecular formula C24H26ClN and a molecular weight of 363.93 g/mol. Its IUPAC name is 1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride.

Molecular Properties

Compound Name1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride
PubChem CID3046625
Molecular FormulaC24H26ClN
Molecular Weight363.93 g/mol
Exact Mass363.18
IUPAC Name1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride
SMILESCl.c1ccc(C(CCN2CCCc3ccccc32)c2ccccc2)cc1
InChIInChI=1S/C24H25N.ClH/c1-3-10-20(11-4-1)23(21-12-5-2-6-13-21)17-19-25-18-9-15-22-14-7-8-16-24(22)25;/h1-8,10-14,16,23H,9,15,17-19H2;1H
InChIKeyBMEYEEORIOJREQ-UHFFFAOYSA-N
XLogP6.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.93
LogP ≤ 56.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride?
The IUPAC name of 1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride (CID 3046625) is 1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride.
What is the SMILES notation for 1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride?
The canonical SMILES for 1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride is Cl.c1ccc(C(CCN2CCCc3ccccc32)c2ccccc2)cc1.
What is the InChIKey of 1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride?
The InChIKey is BMEYEEORIOJREQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N.ClH/c1-3-10-20(11-4-1)23(21-12-5-2-6-13-21)17-19-25-18-9-15-22-14-7-8-16-24(22)25;/h1-8,10-14,16,23H,9,15,17-19H2;1H.
What are the key properties of 1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride?
1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride has a molecular weight of 363.93 g/mol, XLogP of 6.08, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-diphenylpropyl)-3,4-dihydro-2H-quinoline;hydrochloride is sourced from PubChem (CID 3046625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).