2-(2-cyclopropyl-3-methylbutyl)pyridine

C13H19N — CID 54206046

IUPAC2-(2-cyclopropyl-3-methylbutyl)pyridine
SMILESCC(C)C(Cc1ccccn1)C1CC1
InChIInChI=1S/C13H19N/c1-10(2)13(11-6-7-11)9-12-5-3-4-8-14-12/h3-5,8,10-11,13H,6-7,9H2,1-2H3
InChIKeyDOTUPPMJIBNCHS-UHFFFAOYSA-N
MW189.30 g/mol
LogP3.31
Rot. Bonds4

About 2-(2-cyclopropyl-3-methylbutyl)pyridine

2-(2-cyclopropyl-3-methylbutyl)pyridine (PubChem CID 54206046) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 2-(2-cyclopropyl-3-methylbutyl)pyridine.

Molecular Properties

Compound Name2-(2-cyclopropyl-3-methylbutyl)pyridine
PubChem CID54206046
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name2-(2-cyclopropyl-3-methylbutyl)pyridine
SMILESCC(C)C(Cc1ccccn1)C1CC1
InChIInChI=1S/C13H19N/c1-10(2)13(11-6-7-11)9-12-5-3-4-8-14-12/h3-5,8,10-11,13H,6-7,9H2,1-2H3
InChIKeyDOTUPPMJIBNCHS-UHFFFAOYSA-N
XLogP3.31
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-cyclopropyl-1-pyridin-2-ylbutan-2-amine
CID 83155129
2-(2-bromo-3-cyclopropylbutyl)pyridine
CID 83152951
1-cyclopropyl-N-methyl-2-pyridin-2-ylethanamine
CID 63352689
2-(1-cyclopropylethoxymethyl)pyridine
CID 88973388
1-(4-tert-butylcyclohexyl)-2-pyridin-2-ylethanamine
CID 62718393
[1-(4-methylcyclohexyl)-2-pyridin-2-ylethyl]hydrazine
CID 105199922
(2S)-1-pyridin-2-ylpropan-2-amine
CID 42037572
1-cyclohexyl-N-methyl-2-pyridin-2-ylethanamine
CID 60819908
4-methyl-1-pyridin-2-ylpentane-2,3-diol
CID 103456469
[1-(2-methylcyclopropyl)-2-pyridin-2-ylethyl]hydrazine
CID 105234753
2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine
CID 129147354
(3,4-dimethyl-1-pyridin-2-ylpentan-2-yl)hydrazine
CID 105315374

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropyl-3-methylbutyl)pyridine?
The IUPAC name of 2-(2-cyclopropyl-3-methylbutyl)pyridine (CID 54206046) is 2-(2-cyclopropyl-3-methylbutyl)pyridine.
What is the SMILES notation for 2-(2-cyclopropyl-3-methylbutyl)pyridine?
The canonical SMILES for 2-(2-cyclopropyl-3-methylbutyl)pyridine is CC(C)C(Cc1ccccn1)C1CC1.
What is the InChIKey of 2-(2-cyclopropyl-3-methylbutyl)pyridine?
The InChIKey is DOTUPPMJIBNCHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-10(2)13(11-6-7-11)9-12-5-3-4-8-14-12/h3-5,8,10-11,13H,6-7,9H2,1-2H3.
What are the key properties of 2-(2-cyclopropyl-3-methylbutyl)pyridine?
2-(2-cyclopropyl-3-methylbutyl)pyridine has a molecular weight of 189.30 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropyl-3-methylbutyl)pyridine is sourced from PubChem (CID 54206046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).