3-cyclobutyl-5-propylpyridine

C12H17N — CID 166825450

IUPAC3-cyclobutyl-5-propylpyridine
SMILESCCCc1cncc(C2CCC2)c1
InChIInChI=1S/C12H17N/c1-2-4-10-7-12(9-13-8-10)11-5-3-6-11/h7-9,11H,2-6H2,1H3
InChIKeyYVRLYCFUGPSYMV-UHFFFAOYSA-N
MW175.27 g/mol
LogP3.30
Rot. Bonds3

About 3-cyclobutyl-5-propylpyridine

3-cyclobutyl-5-propylpyridine (PubChem CID 166825450) has the molecular formula C12H17N and a molecular weight of 175.27 g/mol. Its IUPAC name is 3-cyclobutyl-5-propylpyridine.

Molecular Properties

Compound Name3-cyclobutyl-5-propylpyridine
PubChem CID166825450
Molecular FormulaC12H17N
Molecular Weight175.27 g/mol
Exact Mass175.14
IUPAC Name3-cyclobutyl-5-propylpyridine
SMILESCCCc1cncc(C2CCC2)c1
InChIInChI=1S/C12H17N/c1-2-4-10-7-12(9-13-8-10)11-5-3-6-11/h7-9,11H,2-6H2,1H3
InChIKeyYVRLYCFUGPSYMV-UHFFFAOYSA-N
XLogP3.30
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-cyclobutylpyridin-3-amine
CID 66520451
4-(5-ethyl-3-pyridinyl)piperidine-1-carboxylic acid
CID 150860508
(5-cyclobutyl-3-pyridinyl)boronic acid
CID 66520453
2-cyclohexyl-5-propylpyrimidine
CID 57193046
3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-propylpyridine;dihydrochloride
CID 67585227
5-cyclohexylpyridine-3-carbaldehyde
CID 82404419
3-(2,2-dimethylpropyl)-5-propylpyridine
CID 129191291
1-tert-butyl-3-[(5-cyclopropyl-3-pyridinyl)methyl]urea
CID 122162869
2-(4-cyclobutylphenyl)-1,3-difluoro-5-(4-propylphenyl)benzene
CID 166999626
5-cyclobutyl-2-ethylpyridin-3-amine
CID 83914783
3-(2-isocyanoethyl)-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 58537427
1-(3-bromocyclohexyl)-4-propylbenzene
CID 64506484

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-5-propylpyridine?
The IUPAC name of 3-cyclobutyl-5-propylpyridine (CID 166825450) is 3-cyclobutyl-5-propylpyridine.
What is the SMILES notation for 3-cyclobutyl-5-propylpyridine?
The canonical SMILES for 3-cyclobutyl-5-propylpyridine is CCCc1cncc(C2CCC2)c1.
What is the InChIKey of 3-cyclobutyl-5-propylpyridine?
The InChIKey is YVRLYCFUGPSYMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-2-4-10-7-12(9-13-8-10)11-5-3-6-11/h7-9,11H,2-6H2,1H3.
What are the key properties of 3-cyclobutyl-5-propylpyridine?
3-cyclobutyl-5-propylpyridine has a molecular weight of 175.27 g/mol, XLogP of 3.30, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-5-propylpyridine is sourced from PubChem (CID 166825450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).