4-cyclohexyl-1-ethyl-2H-pyridine

C13H21N — CID 57026355

IUPAC4-cyclohexyl-1-ethyl-2H-pyridine
SMILESCCN1C=CC(C2CCCCC2)=CC1
InChIInChI=1S/C13H21N/c1-2-14-10-8-13(9-11-14)12-6-4-3-5-7-12/h8-10,12H,2-7,11H2,1H3
InChIKeyTXTCOPBJASSVIS-UHFFFAOYSA-N
MW191.32 g/mol
LogP3.34
Rot. Bonds2

About 4-cyclohexyl-1-ethyl-2H-pyridine

4-cyclohexyl-1-ethyl-2H-pyridine (PubChem CID 57026355) has the molecular formula C13H21N and a molecular weight of 191.32 g/mol. Its IUPAC name is 4-cyclohexyl-1-ethyl-2H-pyridine.

Molecular Properties

Compound Name4-cyclohexyl-1-ethyl-2H-pyridine
PubChem CID57026355
Molecular FormulaC13H21N
Molecular Weight191.32 g/mol
Exact Mass191.17
IUPAC Name4-cyclohexyl-1-ethyl-2H-pyridine
SMILESCCN1C=CC(C2CCCCC2)=CC1
InChIInChI=1S/C13H21N/c1-2-14-10-8-13(9-11-14)12-6-4-3-5-7-12/h8-10,12H,2-7,11H2,1H3
InChIKeyTXTCOPBJASSVIS-UHFFFAOYSA-N
XLogP3.34
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.32
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-Cyclohexyl-1,2-dihydropyridine
CID 5232413
2-[2-(1-methyl-2H-pyridin-5-yl)cyclohexylidene]acetonitrile
CID 53809908
2-(2-ethyl-3,6,6-trimethylcyclohexen-1-yl)-N,N-dimethylethenamine
CID 56991844
2-(2-ethyl-4,6,6-trimethylcyclohexen-1-yl)-N,N-dimethylethenamine
CID 57039076
N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine
CID 57108305
N,N-dimethyl-2-(2,4,6,6-tetramethylcyclohexen-1-yl)ethenamine
CID 57197037
1-butan-2-yl-2H-quinolizine
CID 57646169
(E)-2-[(5Z)-2,4-bis(ethenyl)-5-ethylidenecyclohexen-1-yl]-N,N-dimethylethenamine
CID 58312541
2-[2,4-bis(ethenyl)-5-ethylidenecyclohexen-1-yl]-N,N-dimethylethenamine
CID 76756674
3,7,11,15-tetramethyl-N,N-bis(prop-2-enyl)hexadeca-1,3-dien-1-amine
CID 88699768
3,7,11,15-tetramethyl-N,N-bis(prop-2-enyl)hexadeca-1,3,14-trien-1-amine
CID 88700175
1-Methyl-6-(6-methylcyclohexen-1-yl)pyridine
CID 90698309

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-1-ethyl-2H-pyridine?
The IUPAC name of 4-cyclohexyl-1-ethyl-2H-pyridine (CID 57026355) is 4-cyclohexyl-1-ethyl-2H-pyridine.
What is the SMILES notation for 4-cyclohexyl-1-ethyl-2H-pyridine?
The canonical SMILES for 4-cyclohexyl-1-ethyl-2H-pyridine is CCN1C=CC(C2CCCCC2)=CC1.
What is the InChIKey of 4-cyclohexyl-1-ethyl-2H-pyridine?
The InChIKey is TXTCOPBJASSVIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N/c1-2-14-10-8-13(9-11-14)12-6-4-3-5-7-12/h8-10,12H,2-7,11H2,1H3.
What are the key properties of 4-cyclohexyl-1-ethyl-2H-pyridine?
4-cyclohexyl-1-ethyl-2H-pyridine has a molecular weight of 191.32 g/mol, XLogP of 3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-1-ethyl-2H-pyridine is sourced from PubChem (CID 57026355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).