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Chlorpheniramine

C16H19ClN2 — CID 2725

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Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC3-(4-chlorophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine
SMILESCN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
InChIInChI=1S/C16H19ClN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3
InChIKeySOYKEARSMXGVTM-UHFFFAOYSA-N
MW274.80 g/mol
LogP3.82
Rot. Bonds5

About Chlorpheniramine

Chlorpheniramine (PubChem CID 2725) has the molecular formula C16H19ClN2 and a molecular weight of 274.80 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound NameChlorpheniramine
PubChem CID2725
Molecular FormulaC16H19ClN2
Molecular Weight274.80 g/mol
Exact Mass274.12
IUPAC Name3-(4-chlorophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine
SMILESCN(C)CCC(c1ccc(Cl)cc1)c1ccccn1
InChIInChI=1S/C16H19ClN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3
InChIKeySOYKEARSMXGVTM-UHFFFAOYSA-N
XLogP3.82
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.80
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Triprolidine
CID 5282443
(+-)-Dimethindene
CID 21855
Dexchlorpheniramine Maleate
CID 5281070
Pheniramine
CID 4761
Chlorpheniramine Maleate
CID 5281068
Azatadine
CID 19861
Chlorphenamine Maleate
CID 6433151

Frequently Asked Questions

What is the IUPAC name of Chlorpheniramine?
The IUPAC name of Chlorpheniramine (CID 2725) is 3-(4-chlorophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for Chlorpheniramine?
The canonical SMILES for Chlorpheniramine is CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1.
What is the InChIKey of Chlorpheniramine?
The InChIKey is SOYKEARSMXGVTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3.
What are the key properties of Chlorpheniramine?
Chlorpheniramine has a molecular weight of 274.80 g/mol, XLogP of 3.82, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Chlorpheniramine is sourced from PubChem (CID 2725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

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