4-(4-chlorophenyl)-1,4-dihydropyridine

C11H10ClN — CID 141260635

IUPAC4-(4-chlorophenyl)-1,4-dihydropyridine
SMILESClc1ccc(C2C=CNC=C2)cc1
InChIInChI=1S/C11H10ClN/c12-11-3-1-9(2-4-11)10-5-7-13-8-6-10/h1-8,10,13H
InChIKeyPFOOSSGEJSLTMC-UHFFFAOYSA-N
MW191.66 g/mol
LogP3.05
Rot. Bonds1

About 4-(4-chlorophenyl)-1,4-dihydropyridine

4-(4-chlorophenyl)-1,4-dihydropyridine (PubChem CID 141260635) has the molecular formula C11H10ClN and a molecular weight of 191.66 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-1,4-dihydropyridine.

Molecular Properties

Compound Name4-(4-chlorophenyl)-1,4-dihydropyridine
PubChem CID141260635
Molecular FormulaC11H10ClN
Molecular Weight191.66 g/mol
Exact Mass191.05
IUPAC Name4-(4-chlorophenyl)-1,4-dihydropyridine
SMILESClc1ccc(C2C=CNC=C2)cc1
InChIInChI=1S/C11H10ClN/c12-11-3-1-9(2-4-11)10-5-7-13-8-6-10/h1-8,10,13H
InChIKeyPFOOSSGEJSLTMC-UHFFFAOYSA-N
XLogP3.05
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.66
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,4,6,8-tetrakis(4-chlorophenyl)-3,7-diazabicyclo[3.3.1]nonan-9-one
CID 4050078
(2R,3R)-2,3-bis(4-chlorophenyl)thiirane
CID 11312048
azane;1,4-dichlorobenzene
CID 69330361
1-chloro-4-cyclohexa-2,4-dien-1-ylbenzene
CID 13139025
4,5,9,10-tetrakis(4-chlorophenyl)tricyclo[6.2.0.03,6]decane-2,7-dione
CID 122374957
4,6-bis(4-chlorophenyl)-1,3,5-triazinane-2-thione
CID 13127002
(4S)-4-(4-chlorophenyl)azetidine-2-thione
CID 102306093
(4S,5R)-4-(4-chlorophenyl)-1,3,2-oxathiazolidin-5-ol
CID 35028548
(4S,5S)-4-(4-chlorophenyl)-1,3,2-oxathiazolidin-5-ol
CID 35028553
4-(4-chlorophenyl)-3,3-difluoropiperidine
CID 67962435
4-chlorophenol
CID 4684
3-(4-chlorophenyl)oxetane
CID 130113875

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-1,4-dihydropyridine?
The IUPAC name of 4-(4-chlorophenyl)-1,4-dihydropyridine (CID 141260635) is 4-(4-chlorophenyl)-1,4-dihydropyridine.
What is the SMILES notation for 4-(4-chlorophenyl)-1,4-dihydropyridine?
The canonical SMILES for 4-(4-chlorophenyl)-1,4-dihydropyridine is Clc1ccc(C2C=CNC=C2)cc1.
What is the InChIKey of 4-(4-chlorophenyl)-1,4-dihydropyridine?
The InChIKey is PFOOSSGEJSLTMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN/c12-11-3-1-9(2-4-11)10-5-7-13-8-6-10/h1-8,10,13H.
What are the key properties of 4-(4-chlorophenyl)-1,4-dihydropyridine?
4-(4-chlorophenyl)-1,4-dihydropyridine has a molecular weight of 191.66 g/mol, XLogP of 3.05, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-1,4-dihydropyridine is sourced from PubChem (CID 141260635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).