(5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one

C25H26FN5O3 — CID 25096931

IUPAC(5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one
SMILESCOc1ccc2nccc(N3C[C@@H]4C(NC[C@@H]5CN(c6ccc(C)c(F)c6)C(=O)O5)[C@@H]4C3)c2n1
InChIInChI=1S/C25H26FN5O3/c1-14-3-4-15(9-19(14)26)31-11-16(34-25(31)32)10-28-23-17-12-30(13-18(17)23)21-7-8-27-20-5-6-22(33-2)29-24(20)21/h3-9,16-18,23,28H,10-13H2,1-2H3/t16-,17-,18+,23?/m1/s1
InChIKeyACWAXVRSKKEBKC-PSLLWMRSSA-N
MW463.51 g/mol
LogP3.14
Rot. Bonds6

About (5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one

(5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one (PubChem CID 25096931) has the molecular formula C25H26FN5O3 and a molecular weight of 463.51 g/mol. Its IUPAC name is (5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one
PubChem CID25096931
Molecular FormulaC25H26FN5O3
Molecular Weight463.51 g/mol
Exact Mass463.20
IUPAC Name(5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one
SMILESCOc1ccc2nccc(N3C[C@@H]4C(NC[C@@H]5CN(c6ccc(C)c(F)c6)C(=O)O5)[C@@H]4C3)c2n1
InChIInChI=1S/C25H26FN5O3/c1-14-3-4-15(9-19(14)26)31-11-16(34-25(31)32)10-28-23-17-12-30(13-18(17)23)21-7-8-27-20-5-6-22(33-2)29-24(20)21/h3-9,16-18,23,28H,10-13H2,1-2H3/t16-,17-,18+,23?/m1/s1
InChIKeyACWAXVRSKKEBKC-PSLLWMRSSA-N
XLogP3.14
TPSA79.82 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.51
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze (5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one with MolForge

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Launch Full Analysis

Related Compounds

(5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(3S)-1-(6-methoxy-1,5-naphthyridin-4-yl)pyrrolidin-3-yl]amino]methyl]-1,3-oxazolidin-2-one
CID 25096183
(5S)-3-(3-fluoro-4-methylphenyl)-5-[2-[[1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methylamino]ethyl]-1,3-oxazolidin-2-one
CID 66953920
5-[[[1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]amino]methyl]-3-(4-methoxyphenyl)-1,3-oxazolidin-2-one
CID 66954645
6-[5-[[[1-(6-methoxy-1,5-naphthyridin-4-yl)piperidin-4-yl]amino]methyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-1,4-benzoxazin-3-one
CID 66954697
3-(4-ethoxyphenyl)-5-[[[1-(6-methoxy-1,5-naphthyridin-4-yl)piperidin-4-yl]amino]methyl]-1,3-oxazolidin-2-one
CID 66954206
(5R)-5-[[[(3R)-1-(6-methoxy-1,5-naphthyridin-4-yl)pyrrolidin-3-yl]amino]methyl]-3-(3-oxo-4H-1,4-benzothiazin-6-yl)-1,3-oxazolidin-2-one
CID 25096186
(5R)-5-[[[(3S,4S)-4-hydroxy-1-(6-methoxy-1,5-naphthyridin-4-yl)pyrrolidin-3-yl]methylamino]methyl]-3-(3-oxo-4H-1,4-benzothiazin-6-yl)-1,3-oxazolidin-2-one
CID 66954089
ethyl (3S,4R)-1-(6-methoxy-1,5-naphthyridin-4-yl)-4-[[2-oxo-3-(3-oxo-4H-1,4-benzothiazin-6-yl)-1,3-oxazolidin-5-yl]methylamino]pyrrolidine-3-carboxylate
CID 66954516
ethyl (3S,4R)-1-(6-methoxy-1,5-naphthyridin-4-yl)-4-[[(5S)-2-oxo-3-(3-oxo-4H-1,4-benzothiazin-6-yl)-1,3-oxazolidin-5-yl]methylamino]pyrrolidine-3-carboxylate
CID 66954515
(5R)-5-[[[1-(6-methoxy-1,5-naphthyridin-4-yl)pyrrolidin-3-yl]methylamino]methyl]-3-(3-oxo-4H-1,4-benzothiazin-6-yl)-1,3-oxazolidin-2-one
CID 25096691
(5R)-5-[[4-(6-methoxy-1,5-naphthyridin-4-yl)piperazin-1-yl]methyl]-3-(4-pyrrolidin-1-ylphenyl)-1,3-oxazolidin-2-one
CID 25097709
5-[[4-(6-methoxy-1,5-naphthyridin-4-yl)piperazin-1-yl]methyl]-3-(4-pyrrolidin-1-ylphenyl)-1,3-oxazolidin-2-one
CID 66954338

Frequently Asked Questions

What is the IUPAC name of (5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one (CID 25096931) is (5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one is COc1ccc2nccc(N3C[C@@H]4C(NC[C@@H]5CN(c6ccc(C)c(F)c6)C(=O)O5)[C@@H]4C3)c2n1.
What is the InChIKey of (5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one?
The InChIKey is ACWAXVRSKKEBKC-PSLLWMRSSA-N. The full InChI is InChI=1S/C25H26FN5O3/c1-14-3-4-15(9-19(14)26)31-11-16(34-25(31)32)10-28-23-17-12-30(13-18(17)23)21-7-8-27-20-5-6-22(33-2)29-24(20)21/h3-9,16-18,23,28H,10-13H2,1-2H3/t16-,17-,18+,23?/m1/s1.
What are the key properties of (5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one?
(5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one has a molecular weight of 463.51 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-(3-fluoro-4-methylphenyl)-5-[[[(1S,5R)-3-(6-methoxy-1,5-naphthyridin-4-yl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]methyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 25096931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).