[(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone

C15H21N3O — CID 134555294

IUPAC[(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone
SMILESCC(C)c1ccc2c(n1)CCN(C(=O)[C@H]1CCN1)C2
InChIInChI=1S/C15H21N3O/c1-10(2)12-4-3-11-9-18(8-6-13(11)17-12)15(19)14-5-7-16-14/h3-4,10,14,16H,5-9H2,1-2H3/t14-/m1/s1
InChIKeyLXPOSTRQGSVJRN-CQSZACIVSA-N
MW259.35 g/mol
LogP1.45
Rot. Bonds2

About [(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone

[(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone (PubChem CID 134555294) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is [(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone.

Molecular Properties

Compound Name[(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone
PubChem CID134555294
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name[(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone
SMILESCC(C)c1ccc2c(n1)CCN(C(=O)[C@H]1CCN1)C2
InChIInChI=1S/C15H21N3O/c1-10(2)12-4-3-11-9-18(8-6-13(11)17-12)15(19)14-5-7-16-14/h3-4,10,14,16H,5-9H2,1-2H3/t14-/m1/s1
InChIKeyLXPOSTRQGSVJRN-CQSZACIVSA-N
XLogP1.45
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-methylpyrrolidin-2-yl)-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone
CID 142358596
2-hydroxy-1-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethanone
CID 163544536
2-(4-hydroxypiperidin-1-yl)-1-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethanone
CID 134555329
2-[(3S)-3-hydroxypyrrolidin-1-yl]-1-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethanone
CID 134555308
7,8-dihydro-5H-1,6-naphthyridin-6-yl(pyrrolidin-2-yl)methanone
CID 60862419
1-(2-propan-2-yl-6,8-dihydro-5H-1,7-naphthyridin-7-yl)prop-2-en-1-one
CID 176827651
1-[2-[4-[(2S,4R)-4-hydroxy-2-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)pyrrolidin-1-yl]butan-2-yl]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-2-pyrrolidin-1-ylethanone
CID 134555323
(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 126827187
1-(2-butan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-(4-methylpiperazin-1-yl)ethanone
CID 139539068
7,8-dihydro-5H-1,6-naphthyridin-6-yl(1,3-thiazolidin-4-yl)methanone
CID 60862417
6-(oxetan-3-ylmethyl)-2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridine
CID 134555282
(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(2S)-piperidin-2-yl]methanone
CID 93375324

Frequently Asked Questions

What is the IUPAC name of [(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone?
The IUPAC name of [(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone (CID 134555294) is [(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone.
What is the SMILES notation for [(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone?
The canonical SMILES for [(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone is CC(C)c1ccc2c(n1)CCN(C(=O)[C@H]1CCN1)C2.
What is the InChIKey of [(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone?
The InChIKey is LXPOSTRQGSVJRN-CQSZACIVSA-N. The full InChI is InChI=1S/C15H21N3O/c1-10(2)12-4-3-11-9-18(8-6-13(11)17-12)15(19)14-5-7-16-14/h3-4,10,14,16H,5-9H2,1-2H3/t14-/m1/s1.
What are the key properties of [(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone?
[(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone has a molecular weight of 259.35 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-azetidin-2-yl]-(2-propan-2-yl-7,8-dihydro-5H-1,6-naphthyridin-6-yl)methanone is sourced from PubChem (CID 134555294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).