ethane;4-(1-methylcyclopentyl)pyridine

C13H21N — CID 144662823

IUPACethane;4-(1-methylcyclopentyl)pyridine
SMILESCC.CC1(c2ccncc2)CCCC1
InChIInChI=1S/C11H15N.C2H6/c1-11(6-2-3-7-11)10-4-8-12-9-5-10;1-2/h4-5,8-9H,2-3,6-7H2,1H3;1-2H3
InChIKeyHDICZSYPMOWWED-UHFFFAOYSA-N
MW191.32 g/mol
LogP3.94
Rot. Bonds1

About ethane;4-(1-methylcyclopentyl)pyridine

ethane;4-(1-methylcyclopentyl)pyridine (PubChem CID 144662823) has the molecular formula C13H21N and a molecular weight of 191.32 g/mol. Its IUPAC name is ethane;4-(1-methylcyclopentyl)pyridine.

Molecular Properties

Compound Nameethane;4-(1-methylcyclopentyl)pyridine
PubChem CID144662823
Molecular FormulaC13H21N
Molecular Weight191.32 g/mol
Exact Mass191.17
IUPAC Nameethane;4-(1-methylcyclopentyl)pyridine
SMILESCC.CC1(c2ccncc2)CCCC1
InChIInChI=1S/C11H15N.C2H6/c1-11(6-2-3-7-11)10-4-8-12-9-5-10;1-2/h4-5,8-9H,2-3,6-7H2,1H3;1-2H3
InChIKeyHDICZSYPMOWWED-UHFFFAOYSA-N
XLogP3.94
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.32
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;4-(1-methylcyclopentyl)pyridine?
The IUPAC name of ethane;4-(1-methylcyclopentyl)pyridine (CID 144662823) is ethane;4-(1-methylcyclopentyl)pyridine.
What is the SMILES notation for ethane;4-(1-methylcyclopentyl)pyridine?
The canonical SMILES for ethane;4-(1-methylcyclopentyl)pyridine is CC.CC1(c2ccncc2)CCCC1.
What is the InChIKey of ethane;4-(1-methylcyclopentyl)pyridine?
The InChIKey is HDICZSYPMOWWED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N.C2H6/c1-11(6-2-3-7-11)10-4-8-12-9-5-10;1-2/h4-5,8-9H,2-3,6-7H2,1H3;1-2H3.
What are the key properties of ethane;4-(1-methylcyclopentyl)pyridine?
ethane;4-(1-methylcyclopentyl)pyridine has a molecular weight of 191.32 g/mol, XLogP of 3.94, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-(1-methylcyclopentyl)pyridine is sourced from PubChem (CID 144662823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).