2,3-di(ethylidene)-4-propan-2-ylpyridine

C12H17N — CID 91324852

IUPAC2,3-di(ethylidene)-4-propan-2-ylpyridine
SMILESCC=c1nccc(C(C)C)c1=CC
InChIInChI=1S/C12H17N/c1-5-10-11(9(3)4)7-8-13-12(10)6-2/h5-9H,1-4H3
InChIKeySVNVLCBYRKEHJZ-UHFFFAOYSA-N
MW175.27 g/mol
LogP1.81
Rot. Bonds1

About 2,3-di(ethylidene)-4-propan-2-ylpyridine

2,3-di(ethylidene)-4-propan-2-ylpyridine (PubChem CID 91324852) has the molecular formula C12H17N and a molecular weight of 175.27 g/mol. Its IUPAC name is 2,3-di(ethylidene)-4-propan-2-ylpyridine.

Molecular Properties

Compound Name2,3-di(ethylidene)-4-propan-2-ylpyridine
PubChem CID91324852
Molecular FormulaC12H17N
Molecular Weight175.27 g/mol
Exact Mass175.14
IUPAC Name2,3-di(ethylidene)-4-propan-2-ylpyridine
SMILESCC=c1nccc(C(C)C)c1=CC
InChIInChI=1S/C12H17N/c1-5-10-11(9(3)4)7-8-13-12(10)6-2/h5-9H,1-4H3
InChIKeySVNVLCBYRKEHJZ-UHFFFAOYSA-N
XLogP1.81
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8-Fluoro-4-propan-2-yl-6,7-dihydroquinoline
CID 168883126
5,6-dihydro-4H-indole
CID 57227928
(2E,3Z)-3-[(2,4-dimethylcyclobutyl)methylidene]-2-ethylidenepyridine
CID 71206431
N-[(2Z,4E,6E)-7-methyl-4-(2-methylbutyl)nona-2,4,6,8-tetraen-3-yl]prop-2-en-1-imine
CID 88267020
8-Propan-2-yl-6,7-dihydroquinoline
CID 89144428
N-[(2Z,4Z)-6-ethylnona-2,4-dien-5-yl]ethanimine
CID 89186964
(5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine
CID 89200020
(7R)-7-methyl-6,7-dihydroquinoline
CID 89356030
5,6-Dimethyl-6,7-dihydroquinoline
CID 89495195
4,5-Dimethyl-6,7-dihydroquinoline
CID 89495206
4,7-Dimethyl-6,7-dihydroquinoline
CID 89495207
3-methyl-6-[(4E)-nona-2,4,6-trien-4-yl]-3,4-dihydropyridine
CID 90880500

Frequently Asked Questions

What is the IUPAC name of 2,3-di(ethylidene)-4-propan-2-ylpyridine?
The IUPAC name of 2,3-di(ethylidene)-4-propan-2-ylpyridine (CID 91324852) is 2,3-di(ethylidene)-4-propan-2-ylpyridine.
What is the SMILES notation for 2,3-di(ethylidene)-4-propan-2-ylpyridine?
The canonical SMILES for 2,3-di(ethylidene)-4-propan-2-ylpyridine is CC=c1nccc(C(C)C)c1=CC.
What is the InChIKey of 2,3-di(ethylidene)-4-propan-2-ylpyridine?
The InChIKey is SVNVLCBYRKEHJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-5-10-11(9(3)4)7-8-13-12(10)6-2/h5-9H,1-4H3.
What are the key properties of 2,3-di(ethylidene)-4-propan-2-ylpyridine?
2,3-di(ethylidene)-4-propan-2-ylpyridine has a molecular weight of 175.27 g/mol, XLogP of 1.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-di(ethylidene)-4-propan-2-ylpyridine is sourced from PubChem (CID 91324852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).