(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

C24H26FN5O3 — CID 25096183

IUPAC(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
SMILESCOc1ccc2nccc(N3CC[C@H](NC[C@@H]4CN(c5ccc(C)c(F)c5)C(=O)O4)C3)c2n1
InChIInChI=1S/C24H26FN5O3/c1-15-3-4-17(11-19(15)25)30-14-18(33-24(30)31)12-27-16-8-10-29(13-16)21-7-9-26-20-5-6-22(32-2)28-23(20)21/h3-7,9,11,16,18,27H,8,10,12-14H2,1-2H3/t16-,18+/m0/s1
InChIKeyWXXHADNCYLEZIL-FUHWJXTLSA-N
MW451.50 g/mol
LogP3.28
Rot. Bonds6

About (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

(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 (PubChem CID 25096183) has the molecular formula C24H26FN5O3 and a molecular weight of 451.50 g/mol. Its IUPAC name is (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.

Molecular Properties

Compound Name(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
PubChem CID25096183
Molecular FormulaC24H26FN5O3
Molecular Weight451.50 g/mol
Exact Mass451.20
IUPAC Name(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
SMILESCOc1ccc2nccc(N3CC[C@H](NC[C@@H]4CN(c5ccc(C)c(F)c5)C(=O)O4)C3)c2n1
InChIInChI=1S/C24H26FN5O3/c1-15-3-4-17(11-19(15)25)30-14-18(33-24(30)31)12-27-16-8-10-29(13-16)21-7-9-26-20-5-6-22(32-2)28-23(20)21/h3-7,9,11,16,18,27H,8,10,12-14H2,1-2H3/t16-,18+/m0/s1
InChIKeyWXXHADNCYLEZIL-FUHWJXTLSA-N
XLogP3.28
TPSA79.82 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.50
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze (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 with MolForge

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Related Compounds

(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
(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
5-[[[1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]amino]methyl]-3-(4-methoxyphenyl)-1,3-oxazolidin-2-one
CID 66954645
3-(4-ethoxyphenyl)-5-[[[1-(6-methoxy-1,5-naphthyridin-4-yl)piperidin-4-yl]amino]methyl]-1,3-oxazolidin-2-one
CID 66954206
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
(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
6-[(5R)-5-[[[1-(3-fluoro-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 66954723
6-[5-[[[1-(3-fluoro-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 66954724
(5S)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(3S)-1-(6-methoxy-1,5-naphthyridin-4-yl)pyrrolidin-3-yl]-2-oxo-1,3-oxazolidine-5-carboxamide
CID 25095671
N'-[1-(6-methoxy-1,5-naphthyridin-4-yl)pyrrolidin-3-yl]butane-1,4-diamine
CID 143180996
(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

Frequently Asked Questions

What is the IUPAC name of (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?
The IUPAC name of (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) is (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.
What is the SMILES notation for (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?
The canonical SMILES for (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 is COc1ccc2nccc(N3CC[C@H](NC[C@@H]4CN(c5ccc(C)c(F)c5)C(=O)O4)C3)c2n1.
What is the InChIKey of (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?
The InChIKey is WXXHADNCYLEZIL-FUHWJXTLSA-N. The full InChI is InChI=1S/C24H26FN5O3/c1-15-3-4-17(11-19(15)25)30-14-18(33-24(30)31)12-27-16-8-10-29(13-16)21-7-9-26-20-5-6-22(32-2)28-23(20)21/h3-7,9,11,16,18,27H,8,10,12-14H2,1-2H3/t16-,18+/m0/s1.
What are the key properties of (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?
(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 has a molecular weight of 451.50 g/mol, XLogP of 3.28, 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-[[[(3S)-1-(6-methoxy-1,5-naphthyridin-4-yl)pyrrolidin-3-yl]amino]methyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 25096183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).