Triprolidine Hydrochloride Anhydrous

C19H23ClN2 — CID 5702129

IUPAC2-[(E)-1-(4-methylphenyl)-3-pyrrolidin-1-ylprop-1-enyl]pyridine;hydrochloride
SMILESCC1=CC=C(C=C1)/C(=C\CN2CCCC2)/C3=CC=CC=N3.Cl
InChIInChI=1S/C19H22N2.ClH/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21;/h2-3,6-12H,4-5,13-15H2,1H3;1H/b18-11+;
InChIKeyWYUYEJNGHIOFOC-NWBUNABESA-N
MW314.90 g/mol
LogP—
Rot. Bonds4

About Triprolidine Hydrochloride Anhydrous

Triprolidine Hydrochloride Anhydrous (PubChem CID 5702129) has the molecular formula C19H23ClN2 and a molecular weight of 314.90 g/mol. Its IUPAC name is 2-[(E)-1-(4-methylphenyl)-3-pyrrolidin-1-ylprop-1-enyl]pyridine;hydrochloride.

Molecular Properties

Compound NameTriprolidine Hydrochloride Anhydrous
PubChem CID5702129
Molecular FormulaC19H23ClN2
Molecular Weight314.90 g/mol
Exact Mass314.15
IUPAC Name2-[(E)-1-(4-methylphenyl)-3-pyrrolidin-1-ylprop-1-enyl]pyridine;hydrochloride
SMILESCC1=CC=C(C=C1)/C(=C\CN2CCCC2)/C3=CC=CC=N3.Cl
InChIInChI=1S/C19H22N2.ClH/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21;/h2-3,6-12H,4-5,13-15H2,1H3;1H/b18-11+;
InChIKeyWYUYEJNGHIOFOC-NWBUNABESA-N
XLogP—
TPSA16.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity335

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Nicotine
CID 89594
(+-)-Chlorpheniramine
CID 2725
Triprolidine
CID 5282443
Brompheniramine
CID 6834
(+-)-Dimethindene
CID 21855
Dexchlorpheniramine
CID 33036
3-(1-Methylpyrrolidin-2-yl)pyridine
CID 942
Pheniramine
CID 4761
Myosmine
CID 442649
Azatadine
CID 19861
5-Ethyl-2-methylpyridine
CID 7728
5,5'-Dimethyl-2,2'-bipyridyl
CID 15664

Frequently Asked Questions

What is the IUPAC name of Triprolidine Hydrochloride Anhydrous?
The IUPAC name of Triprolidine Hydrochloride Anhydrous (CID 5702129) is 2-[(E)-1-(4-methylphenyl)-3-pyrrolidin-1-ylprop-1-enyl]pyridine;hydrochloride.
What is the SMILES notation for Triprolidine Hydrochloride Anhydrous?
The canonical SMILES for Triprolidine Hydrochloride Anhydrous is CC1=CC=C(C=C1)/C(=C\CN2CCCC2)/C3=CC=CC=N3.Cl.
What is the InChIKey of Triprolidine Hydrochloride Anhydrous?
The InChIKey is WYUYEJNGHIOFOC-NWBUNABESA-N. The full InChI is InChI=1S/C19H22N2.ClH/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21;/h2-3,6-12H,4-5,13-15H2,1H3;1H/b18-11+;.
What are the key properties of Triprolidine Hydrochloride Anhydrous?
Triprolidine Hydrochloride Anhydrous has a molecular weight of 314.90 g/mol, XLogP of not available, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Triprolidine Hydrochloride Anhydrous is sourced from PubChem (CID 5702129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).