(7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine

C15H24N2O — CID 168846431

IUPAC(7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine
SMILESCOc1nc2c(cc1C(C)(C)C)CN(C)[C@H](C)C2
InChIInChI=1S/C15H24N2O/c1-10-7-13-11(9-17(10)5)8-12(15(2,3)4)14(16-13)18-6/h8,10H,7,9H2,1-6H3/t10-/m1/s1
InChIKeySUJMDKNRGJXPSR-SNVBAGLBSA-N
MW248.37 g/mol
LogP2.76
Rot. Bonds1

About (7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine

(7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine (PubChem CID 168846431) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is (7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine.

Molecular Properties

Compound Name(7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine
PubChem CID168846431
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name(7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine
SMILESCOc1nc2c(cc1C(C)(C)C)CN(C)[C@H](C)C2
InChIInChI=1S/C15H24N2O/c1-10-7-13-11(9-17(10)5)8-12(15(2,3)4)14(16-13)18-6/h8,10H,7,9H2,1-6H3/t10-/m1/s1
InChIKeySUJMDKNRGJXPSR-SNVBAGLBSA-N
XLogP2.76
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine?
The IUPAC name of (7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine (CID 168846431) is (7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine.
What is the SMILES notation for (7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine?
The canonical SMILES for (7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine is COc1nc2c(cc1C(C)(C)C)CN(C)[C@H](C)C2.
What is the InChIKey of (7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine?
The InChIKey is SUJMDKNRGJXPSR-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H24N2O/c1-10-7-13-11(9-17(10)5)8-12(15(2,3)4)14(16-13)18-6/h8,10H,7,9H2,1-6H3/t10-/m1/s1.
What are the key properties of (7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine?
(7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine has a molecular weight of 248.37 g/mol, XLogP of 2.76, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-3-tert-butyl-2-methoxy-6,7-dimethyl-7,8-dihydro-5H-1,6-naphthyridine is sourced from PubChem (CID 168846431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).