1,8-naphthyridine;propane

C11H14N2 — CID 142433930

IUPAC1,8-naphthyridine;propane
SMILESCCC.c1cnc2ncccc2c1
InChIInChI=1S/C8H6N2.C3H8/c1-3-7-4-2-6-10-8(7)9-5-1;1-3-2/h1-6H;3H2,1-2H3
InChIKeyBOTKOTIQLTUUTI-UHFFFAOYSA-N
MW174.25 g/mol
LogP3.05
Rot. Bonds

About 1,8-naphthyridine;propane

1,8-naphthyridine;propane (PubChem CID 142433930) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 1,8-naphthyridine;propane.

Molecular Properties

Compound Name1,8-naphthyridine;propane
PubChem CID142433930
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name1,8-naphthyridine;propane
SMILESCCC.c1cnc2ncccc2c1
InChIInChI=1S/C8H6N2.C3H8/c1-3-7-4-2-6-10-8(7)9-5-1;1-3-2/h1-6H;3H2,1-2H3
InChIKeyBOTKOTIQLTUUTI-UHFFFAOYSA-N
XLogP3.05
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

coronene;1,8-naphthyridine
CID 87840875
2-ethoxy-1,8-naphthyridine
CID 4053994
1,8-naphthyridine;piperazine
CID 157389388
2-pentyl-1,8-naphthyridine
CID 11481079
2-(methoxymethyl)-1,8-naphthyridine
CID 154147005
cyclohexene;1,8-naphthyridine
CID 174681828
ethane;1,5-naphthyridine;propane
CID 142434189
carbanide;copper;1,8-naphthyridine;triphenylphosphanium
CID 159038461
ethane;3-methyl-1,8-naphthyridine
CID 90816561
1,8-naphthyridine;1,3-thiazole
CID 159395444
CID 177046981
CID 177046981
CID 177047265
CID 177047265

Frequently Asked Questions

What is the IUPAC name of 1,8-naphthyridine;propane?
The IUPAC name of 1,8-naphthyridine;propane (CID 142433930) is 1,8-naphthyridine;propane.
What is the SMILES notation for 1,8-naphthyridine;propane?
The canonical SMILES for 1,8-naphthyridine;propane is CCC.c1cnc2ncccc2c1.
What is the InChIKey of 1,8-naphthyridine;propane?
The InChIKey is BOTKOTIQLTUUTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2.C3H8/c1-3-7-4-2-6-10-8(7)9-5-1;1-3-2/h1-6H;3H2,1-2H3.
What are the key properties of 1,8-naphthyridine;propane?
1,8-naphthyridine;propane has a molecular weight of 174.25 g/mol, XLogP of 3.05, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-naphthyridine;propane is sourced from PubChem (CID 142433930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).