butane;ethane;4-propylpyridine;pyridine

C19H32N2 — CID 143414684

IUPACbutane;ethane;4-propylpyridine;pyridine
SMILESCC.CCCC.CCCc1ccncc1.c1ccncc1
InChIInChI=1S/C8H11N.C5H5N.C4H10.C2H6/c1-2-3-8-4-6-9-7-5-8;1-2-4-6-5-3-1;1-3-4-2;1-2/h4-7H,2-3H2,1H3;1-5H;3-4H2,1-2H3;1-2H3
InChIKeyQODKUYIESZPALO-UHFFFAOYSA-N
MW288.48 g/mol
LogP5.95
Rot. Bonds3

About butane;ethane;4-propylpyridine;pyridine

butane;ethane;4-propylpyridine;pyridine (PubChem CID 143414684) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is butane;ethane;4-propylpyridine;pyridine.

Molecular Properties

Compound Namebutane;ethane;4-propylpyridine;pyridine
PubChem CID143414684
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC Namebutane;ethane;4-propylpyridine;pyridine
SMILESCC.CCCC.CCCc1ccncc1.c1ccncc1
InChIInChI=1S/C8H11N.C5H5N.C4H10.C2H6/c1-2-3-8-4-6-9-7-5-8;1-2-4-6-5-3-1;1-3-4-2;1-2/h4-7H,2-3H2,1H3;1-5H;3-4H2,1-2H3;1-2H3
InChIKeyQODKUYIESZPALO-UHFFFAOYSA-N
XLogP5.95
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.48
LogP ≤ 55.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of butane;ethane;4-propylpyridine;pyridine?
The IUPAC name of butane;ethane;4-propylpyridine;pyridine (CID 143414684) is butane;ethane;4-propylpyridine;pyridine.
What is the SMILES notation for butane;ethane;4-propylpyridine;pyridine?
The canonical SMILES for butane;ethane;4-propylpyridine;pyridine is CC.CCCC.CCCc1ccncc1.c1ccncc1.
What is the InChIKey of butane;ethane;4-propylpyridine;pyridine?
The InChIKey is QODKUYIESZPALO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.C5H5N.C4H10.C2H6/c1-2-3-8-4-6-9-7-5-8;1-2-4-6-5-3-1;1-3-4-2;1-2/h4-7H,2-3H2,1H3;1-5H;3-4H2,1-2H3;1-2H3.
What are the key properties of butane;ethane;4-propylpyridine;pyridine?
butane;ethane;4-propylpyridine;pyridine has a molecular weight of 288.48 g/mol, XLogP of 5.95, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butane;ethane;4-propylpyridine;pyridine is sourced from PubChem (CID 143414684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).