ethane;3-ethyl-1,7-naphthyridine

C12H16N2 — CID 169252229

IUPACethane;3-ethyl-1,7-naphthyridine
SMILESCC.CCc1cnc2cnccc2c1
InChIInChI=1S/C10H10N2.C2H6/c1-2-8-5-9-3-4-11-7-10(9)12-6-8;1-2/h3-7H,2H2,1H3;1-2H3
InChIKeyVJVJLWWVNAQNLF-UHFFFAOYSA-N
MW188.27 g/mol
LogP3.22
Rot. Bonds1

About ethane;3-ethyl-1,7-naphthyridine

ethane;3-ethyl-1,7-naphthyridine (PubChem CID 169252229) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is ethane;3-ethyl-1,7-naphthyridine.

Molecular Properties

Compound Nameethane;3-ethyl-1,7-naphthyridine
PubChem CID169252229
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Nameethane;3-ethyl-1,7-naphthyridine
SMILESCC.CCc1cnc2cnccc2c1
InChIInChI=1S/C10H10N2.C2H6/c1-2-8-5-9-3-4-11-7-10(9)12-6-8;1-2/h3-7H,2H2,1H3;1-2H3
InChIKeyVJVJLWWVNAQNLF-UHFFFAOYSA-N
XLogP3.22
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-1-(1,7-naphthyridin-3-yl)propan-2-amine
CID 84776421
3,6-diethylquinoline
CID 82111628
3-ethylquinoline;quinoline
CID 174966721
1-[2-(1,7-naphthyridin-3-yl)ethyl]cyclopropan-1-amine
CID 105467013
3-ethyl-7-methoxyquinoline
CID 14361549
3-(bromomethyl)-6-ethylquinoline
CID 95733003
1,6-naphthyridin-3-ylmethanesulfonyl chloride
CID 84801776
ethane;6-ethylquinoline;propane;7-propan-2-ylisoquinoline
CID 164904898
ethane;4-ethylpyridine
CID 142005045
1,7-naphthyridine-3-carbohydrazide
CID 69234324
ethane;5-ethyl-1H-pyrazolo[5,4-b]pyridine
CID 176692042
6-ethylcinnoline
CID 70647783

Frequently Asked Questions

What is the IUPAC name of ethane;3-ethyl-1,7-naphthyridine?
The IUPAC name of ethane;3-ethyl-1,7-naphthyridine (CID 169252229) is ethane;3-ethyl-1,7-naphthyridine.
What is the SMILES notation for ethane;3-ethyl-1,7-naphthyridine?
The canonical SMILES for ethane;3-ethyl-1,7-naphthyridine is CC.CCc1cnc2cnccc2c1.
What is the InChIKey of ethane;3-ethyl-1,7-naphthyridine?
The InChIKey is VJVJLWWVNAQNLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2.C2H6/c1-2-8-5-9-3-4-11-7-10(9)12-6-8;1-2/h3-7H,2H2,1H3;1-2H3.
What are the key properties of ethane;3-ethyl-1,7-naphthyridine?
ethane;3-ethyl-1,7-naphthyridine has a molecular weight of 188.27 g/mol, XLogP of 3.22, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethyl-1,7-naphthyridine is sourced from PubChem (CID 169252229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).