ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine

C13H20N2 — CID 166091221

IUPACethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine
SMILESCC.CC(C)c1ccc2c(n1)C=CCN2
InChIInChI=1S/C11H14N2.C2H6/c1-8(2)9-5-6-10-11(13-9)4-3-7-12-10;1-2/h3-6,8,12H,7H2,1-2H3;1-2H3
InChIKeyUUCRFOVASKFIBK-UHFFFAOYSA-N
MW204.32 g/mol
LogP3.67
Rot. Bonds1

About ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine

ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine (PubChem CID 166091221) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine.

Molecular Properties

Compound Nameethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine
PubChem CID166091221
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Nameethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine
SMILESCC.CC(C)c1ccc2c(n1)C=CCN2
InChIInChI=1S/C11H14N2.C2H6/c1-8(2)9-5-6-10-11(13-9)4-3-7-12-10;1-2/h3-6,8,12H,7H2,1-2H3;1-2H3
InChIKeyUUCRFOVASKFIBK-UHFFFAOYSA-N
XLogP3.67
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine?
The IUPAC name of ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine (CID 166091221) is ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine.
What is the SMILES notation for ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine?
The canonical SMILES for ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine is CC.CC(C)c1ccc2c(n1)C=CCN2.
What is the InChIKey of ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine?
The InChIKey is UUCRFOVASKFIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2.C2H6/c1-8(2)9-5-6-10-11(13-9)4-3-7-12-10;1-2/h3-6,8,12H,7H2,1-2H3;1-2H3.
What are the key properties of ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine?
ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine has a molecular weight of 204.32 g/mol, XLogP of 3.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-propan-2-yl-1,2-dihydro-1,5-naphthyridine is sourced from PubChem (CID 166091221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).