tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate

C16H18N4O2 — CID 170968156

IUPACtert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate
SMILESCc1cc2cnc(NC(=O)OC(C)(C)C)cc2c2nccn12
InChIInChI=1S/C16H18N4O2/c1-10-7-11-9-18-13(19-15(21)22-16(2,3)4)8-12(11)14-17-5-6-20(10)14/h5-9H,1-4H3,(H,18,19,21)
InChIKeyGVWGYOOUPPJFKP-UHFFFAOYSA-N
MW298.35 g/mol
LogP3.54
Rot. Bonds1

About tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate

tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate (PubChem CID 170968156) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate
PubChem CID170968156
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC Nametert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate
SMILESCc1cc2cnc(NC(=O)OC(C)(C)C)cc2c2nccn12
InChIInChI=1S/C16H18N4O2/c1-10-7-11-9-18-13(19-15(21)22-16(2,3)4)8-12(11)14-17-5-6-20(10)14/h5-9H,1-4H3,(H,18,19,21)
InChIKeyGVWGYOOUPPJFKP-UHFFFAOYSA-N
XLogP3.54
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

tert-butyl N-(4,5-dimethyl-2-pyridinyl)carbamate
CID 58477930
tert-butyl N-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pyrazin-2-yl]carbamate
CID 11012344
tert-butyl N-(4-fluoro-5-formyl-2-pyridinyl)carbamate
CID 142536295
tert-butyl N-(2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-6-yl)carbamate
CID 170899240
tert-butyl N-(1-acetylpyrazolo[3,4-c]pyridin-5-yl)carbamate
CID 76764456
tert-butyl N-[1-(3,3,3-trifluoropropyl)pyrazolo[3,4-c]pyridin-5-yl]carbamate
CID 162753187
5-fluoro-2-[(2-methylpropan-2-yl)oxycarbonylamino]pyridine-4-carboxylic acid
CID 137407913
tert-butyl N-pyrazin-2-ylcarbamate;ethane
CID 153338007
tert-butyl N-[6-(methylamino)pyrimidin-4-yl]carbamate
CID 86086992
tert-butyl N-[2-(2,6-dimethylpyrrolo[2,3-d]pyrimidin-7-yl)-3,3-dimethylbutyl]carbamate
CID 170077871
tert-butyl N-[5-(bromomethyl)pyrazin-2-yl]carbamate;ethane
CID 143167789
tert-butyl N-[4-(4-methyl-6-propanoyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a][1,6]naphthyridin-8-yl]carbamate
CID 170968346

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate?
The IUPAC name of tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate (CID 170968156) is tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate.
What is the SMILES notation for tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate?
The canonical SMILES for tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate is Cc1cc2cnc(NC(=O)OC(C)(C)C)cc2c2nccn12.
What is the InChIKey of tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate?
The InChIKey is GVWGYOOUPPJFKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c1-10-7-11-9-18-13(19-15(21)22-16(2,3)4)8-12(11)14-17-5-6-20(10)14/h5-9H,1-4H3,(H,18,19,21).
What are the key properties of tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate?
tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate has a molecular weight of 298.35 g/mol, XLogP of 3.54, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(5-methylimidazo[2,1-a][2,6]naphthyridin-9-yl)carbamate is sourced from PubChem (CID 170968156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).