5-cyclopropyl-2-propyl-2,3-dihydropyridine

C11H17N — CID 123324115

IUPAC5-cyclopropyl-2-propyl-2,3-dihydropyridine
SMILESCCCC1CC=C(C2CC2)C=N1
InChIInChI=1S/C11H17N/c1-2-3-11-7-6-10(8-12-11)9-4-5-9/h6,8-9,11H,2-5,7H2,1H3
InChIKeyCBWUOWGOPLCBSN-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.97
Rot. Bonds3

About 5-cyclopropyl-2-propyl-2,3-dihydropyridine

5-cyclopropyl-2-propyl-2,3-dihydropyridine (PubChem CID 123324115) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is 5-cyclopropyl-2-propyl-2,3-dihydropyridine.

Molecular Properties

Compound Name5-cyclopropyl-2-propyl-2,3-dihydropyridine
PubChem CID123324115
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name5-cyclopropyl-2-propyl-2,3-dihydropyridine
SMILESCCCC1CC=C(C2CC2)C=N1
InChIInChI=1S/C11H17N/c1-2-3-11-7-6-10(8-12-11)9-4-5-9/h6,8-9,11H,2-5,7H2,1H3
InChIKeyCBWUOWGOPLCBSN-UHFFFAOYSA-N
XLogP2.97
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-cyclopropyl-2-propyl-2,3-dihydropyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-N-cyclohexyl-2-ethylbut-2-en-1-imine
CID 127262357
(S,e)-5-(2-methylbutylidene)-2,3,4,5-tetrahydropyridine
CID 129849200
3-Ethyl-5-(3-fluorobutyl)-2,3-dihydropyridine
CID 144096701
2-[Cyclopropyl(difluoro)methyl]-5-methyl-2,3-dihydropyridine
CID 162560059
2-Ethyl-3,5-dimethyl-2,3-dihydropyridine
CID 12478339
(E)-N-cyclohexyl-2-ethylhept-2-en-1-imine
CID 23394363
2,3,4-Trimethyl-2,3-dihydropyridine
CID 53836102
3,5-Diethyl-2,3-dihydropyridine
CID 54235037
3,5-Diethyl-2-propyl-2,5-dihydropyridine
CID 57118688
2-[(E)-2,3-dimethylbut-1-enyl]-5-methyl-2,3-dihydropyridine
CID 59887793
2-[(E)-2,3-dimethylbut-1-enyl]-4-methyl-2,3-dihydropyridine
CID 59887795
(3S)-2,3,4-trimethyl-2,3-dihydropyridine
CID 68030579

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-propyl-2,3-dihydropyridine?
The IUPAC name of 5-cyclopropyl-2-propyl-2,3-dihydropyridine (CID 123324115) is 5-cyclopropyl-2-propyl-2,3-dihydropyridine.
What is the SMILES notation for 5-cyclopropyl-2-propyl-2,3-dihydropyridine?
The canonical SMILES for 5-cyclopropyl-2-propyl-2,3-dihydropyridine is CCCC1CC=C(C2CC2)C=N1.
What is the InChIKey of 5-cyclopropyl-2-propyl-2,3-dihydropyridine?
The InChIKey is CBWUOWGOPLCBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-2-3-11-7-6-10(8-12-11)9-4-5-9/h6,8-9,11H,2-5,7H2,1H3.
What are the key properties of 5-cyclopropyl-2-propyl-2,3-dihydropyridine?
5-cyclopropyl-2-propyl-2,3-dihydropyridine has a molecular weight of 163.26 g/mol, XLogP of 2.97, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-propyl-2,3-dihydropyridine is sourced from PubChem (CID 123324115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).