1,8-di(propan-2-yl)-2,7-naphthyridine

C14H18N2 — CID 170669033

IUPAC1,8-di(propan-2-yl)-2,7-naphthyridine
SMILESCC(C)c1nccc2ccnc(C(C)C)c12
InChIInChI=1S/C14H18N2/c1-9(2)13-12-11(5-7-15-13)6-8-16-14(12)10(3)4/h5-10H,1-4H3
InChIKeyAGJKMYQKWWMING-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.88
Rot. Bonds2

About 1,8-di(propan-2-yl)-2,7-naphthyridine

1,8-di(propan-2-yl)-2,7-naphthyridine (PubChem CID 170669033) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1,8-di(propan-2-yl)-2,7-naphthyridine.

Molecular Properties

Compound Name1,8-di(propan-2-yl)-2,7-naphthyridine
PubChem CID170669033
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name1,8-di(propan-2-yl)-2,7-naphthyridine
SMILESCC(C)c1nccc2ccnc(C(C)C)c12
InChIInChI=1S/C14H18N2/c1-9(2)13-12-11(5-7-15-13)6-8-16-14(12)10(3)4/h5-10H,1-4H3
InChIKeyAGJKMYQKWWMING-UHFFFAOYSA-N
XLogP3.88
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,8-di(propan-2-yl)-2,7-naphthyridine?
The IUPAC name of 1,8-di(propan-2-yl)-2,7-naphthyridine (CID 170669033) is 1,8-di(propan-2-yl)-2,7-naphthyridine.
What is the SMILES notation for 1,8-di(propan-2-yl)-2,7-naphthyridine?
The canonical SMILES for 1,8-di(propan-2-yl)-2,7-naphthyridine is CC(C)c1nccc2ccnc(C(C)C)c12.
What is the InChIKey of 1,8-di(propan-2-yl)-2,7-naphthyridine?
The InChIKey is AGJKMYQKWWMING-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-9(2)13-12-11(5-7-15-13)6-8-16-14(12)10(3)4/h5-10H,1-4H3.
What are the key properties of 1,8-di(propan-2-yl)-2,7-naphthyridine?
1,8-di(propan-2-yl)-2,7-naphthyridine has a molecular weight of 214.31 g/mol, XLogP of 3.88, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-di(propan-2-yl)-2,7-naphthyridine is sourced from PubChem (CID 170669033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).