2-(3-ethyl-4-methylpentyl)pyridine

C13H21N — CID 67454741

IUPAC2-(3-ethyl-4-methylpentyl)pyridine
SMILESCCC(CCc1ccccn1)C(C)C
InChIInChI=1S/C13H21N/c1-4-12(11(2)3)8-9-13-7-5-6-10-14-13/h5-7,10-12H,4,8-9H2,1-3H3
InChIKeyBBHIYPJJJFPOIE-UHFFFAOYSA-N
MW191.32 g/mol
LogP3.70
Rot. Bonds5

About 2-(3-ethyl-4-methylpentyl)pyridine

2-(3-ethyl-4-methylpentyl)pyridine (PubChem CID 67454741) has the molecular formula C13H21N and a molecular weight of 191.32 g/mol. Its IUPAC name is 2-(3-ethyl-4-methylpentyl)pyridine.

Molecular Properties

Compound Name2-(3-ethyl-4-methylpentyl)pyridine
PubChem CID67454741
Molecular FormulaC13H21N
Molecular Weight191.32 g/mol
Exact Mass191.17
IUPAC Name2-(3-ethyl-4-methylpentyl)pyridine
SMILESCCC(CCc1ccccn1)C(C)C
InChIInChI=1S/C13H21N/c1-4-12(11(2)3)8-9-13-7-5-6-10-14-13/h5-7,10-12H,4,8-9H2,1-3H3
InChIKeyBBHIYPJJJFPOIE-UHFFFAOYSA-N
XLogP3.70
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.32
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-4-pyridin-2-ylbutan-2-amine
CID 22831528
2-(3-methyloctyl)pyridine;hydrochloride
CID 172780204
N-ethyl-4-methyl-1-pyridin-2-ylpentan-3-amine
CID 105078244
N-ethyl-4-methyl-1-pyridin-2-ylhexan-3-amine
CID 105170568
3-ethyl-2-N-methyl-2-N-(2-pyridin-2-ylethyl)pentane-1,2-diamine
CID 43187234
2-[4-pyridin-2-yl-2-(2-pyridin-2-ylethyl)butyl]pyridine
CID 175722818
(2R)-5-pyridin-2-ylpentan-2-ol
CID 149104953
3-methyl-2-[methyl(2-pyridin-2-ylethyl)amino]butan-1-ol
CID 115137806
N,4-dimethyl-1-pyridin-2-ylheptan-3-amine
CID 107894010
chromium;2-pentylpyridine;hydrochloride
CID 175220071
2-tetradecylpyridine;hydrochloride
CID 45489746
ethane;N-methyl-N-(2-pyridin-2-ylethyl)propan-2-amine
CID 142585406

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-4-methylpentyl)pyridine?
The IUPAC name of 2-(3-ethyl-4-methylpentyl)pyridine (CID 67454741) is 2-(3-ethyl-4-methylpentyl)pyridine.
What is the SMILES notation for 2-(3-ethyl-4-methylpentyl)pyridine?
The canonical SMILES for 2-(3-ethyl-4-methylpentyl)pyridine is CCC(CCc1ccccn1)C(C)C.
What is the InChIKey of 2-(3-ethyl-4-methylpentyl)pyridine?
The InChIKey is BBHIYPJJJFPOIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N/c1-4-12(11(2)3)8-9-13-7-5-6-10-14-13/h5-7,10-12H,4,8-9H2,1-3H3.
What are the key properties of 2-(3-ethyl-4-methylpentyl)pyridine?
2-(3-ethyl-4-methylpentyl)pyridine has a molecular weight of 191.32 g/mol, XLogP of 3.70, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-4-methylpentyl)pyridine is sourced from PubChem (CID 67454741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).