6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine

C13H18N2 — CID 3058703

IUPAC6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine
SMILESc1cnc2c(c1)CN(CC1CCC1)CC2
InChIInChI=1S/C13H18N2/c1-3-11(4-1)9-15-8-6-13-12(10-15)5-2-7-14-13/h2,5,7,11H,1,3-4,6,8-10H2
InChIKeyWYVOMCVYMOFIGC-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.24
Rot. Bonds2

About 6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine

6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine (PubChem CID 3058703) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine.

Molecular Properties

Compound Name6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine
PubChem CID3058703
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine
SMILESc1cnc2c(c1)CN(CC1CCC1)CC2
InChIInChI=1S/C13H18N2/c1-3-11(4-1)9-15-8-6-13-12(10-15)5-2-7-14-13/h2,5,7,11H,1,3-4,6,8-10H2
InChIKeyWYVOMCVYMOFIGC-UHFFFAOYSA-N
XLogP2.24
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine?
The IUPAC name of 6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine (CID 3058703) is 6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine.
What is the SMILES notation for 6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine?
The canonical SMILES for 6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine is c1cnc2c(c1)CN(CC1CCC1)CC2.
What is the InChIKey of 6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine?
The InChIKey is WYVOMCVYMOFIGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-3-11(4-1)9-15-8-6-13-12(10-15)5-2-7-14-13/h2,5,7,11H,1,3-4,6,8-10H2.
What are the key properties of 6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine?
6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine has a molecular weight of 202.30 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclobutylmethyl)-7,8-dihydro-5H-1,6-naphthyridine is sourced from PubChem (CID 3058703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).