(5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide

C17H18FN5O3 — CID 58746357

IUPAC(5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide
SMILESCNc1n[nH]c2c1CCCc1cc(N3C[C@H](C(N)=O)OC3=O)cc(F)c1-2
InChIInChI=1S/C17H18FN5O3/c1-20-16-10-4-2-3-8-5-9(6-11(18)13(8)14(10)21-22-16)23-7-12(15(19)24)26-17(23)25/h5-6,12H,2-4,7H2,1H3,(H2,19,24)(H2,20,21,22)/t12-/m1/s1
InChIKeyUTFFIPPQFMDCFC-GFCCVEGCSA-N
MW359.36 g/mol
LogP1.56
Rot. Bonds3

About (5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide

(5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide (PubChem CID 58746357) has the molecular formula C17H18FN5O3 and a molecular weight of 359.36 g/mol. Its IUPAC name is (5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide.

Molecular Properties

Compound Name(5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide
PubChem CID58746357
Molecular FormulaC17H18FN5O3
Molecular Weight359.36 g/mol
Exact Mass359.14
IUPAC Name(5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide
SMILESCNc1n[nH]c2c1CCCc1cc(N3C[C@H](C(N)=O)OC3=O)cc(F)c1-2
InChIInChI=1S/C17H18FN5O3/c1-20-16-10-4-2-3-8-5-9(6-11(18)13(8)14(10)21-22-16)23-7-12(15(19)24)26-17(23)25/h5-6,12H,2-4,7H2,1H3,(H2,19,24)(H2,20,21,22)/t12-/m1/s1
InChIKeyUTFFIPPQFMDCFC-GFCCVEGCSA-N
XLogP1.56
TPSA113.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.36
LogP ≤ 51.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide with MolForge

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Related Compounds

(5R)-3-[5-(1,2-oxazol-5-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2,5,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide
CID 58746277
(5R)-3-(7-fluoro-1-methyl-2-oxo-3H-indol-5-yl)-2-oxo-1,3-oxazolidine-5-carboxamide
CID 11536643
3-[4-(1,1-dioxo-1,4-thiazepan-4-yl)-3,5-difluorophenyl]-2-oxo-1,3-oxazolidine-5-carboxamide
CID 11625257
(5R)-3-(4-fluoro-3-methyl-2-oxo-1,3-benzothiazol-6-yl)-2-oxo-1,3-oxazolidine-5-carboxamide
CID 10215035
(5R)-3-(3,5-difluoro-4-morpholin-4-ylphenyl)-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide
CID 10215354
N-[[(5S)-3-[5-(4-fluorofuran-3-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 10025361
3-[3,5-difluoro-4-(thiazepan-4-yl)phenyl]-2-oxo-1,3-oxazolidine-5-carboxamide
CID 69475435
(5R)-3-[3-fluoro-4-(4-hydroxycyclohexyl)phenyl]-2-oxo-1,3-oxazolidine-5-carboxamide;(5R)-3-[3-fluoro-4-(4-oxocyclohexyl)phenyl]-2-oxo-1,3-oxazolidine-5-carboxamide
CID 159385932
tert-butyl 3-[4-(5-carbamoyl-2-oxo-1,3-oxazolidin-3-yl)-2,6-difluorophenyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate
CID 22505086
(5R)-3-(7-fluoro-3-methoxy-4,5-dihydro-1H-[1]benzoxepino[4,5-d]pyrazol-8-yl)-2-oxo-1,3-oxazolidine-5-carboxamide
CID 58746240
methyl 3-[2,6-difluoro-4-[(5R)-5-(methylcarbamoyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]-3-methylazetidine-1-carboxylate
CID 10287278
(5R)-3-(4-cyclohexyl-3-fluorophenyl)-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide
CID 58746248

Frequently Asked Questions

What is the IUPAC name of (5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide?
The IUPAC name of (5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide (CID 58746357) is (5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide.
What is the SMILES notation for (5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide?
The canonical SMILES for (5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide is CNc1n[nH]c2c1CCCc1cc(N3C[C@H](C(N)=O)OC3=O)cc(F)c1-2.
What is the InChIKey of (5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide?
The InChIKey is UTFFIPPQFMDCFC-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H18FN5O3/c1-20-16-10-4-2-3-8-5-9(6-11(18)13(8)14(10)21-22-16)23-7-12(15(19)24)26-17(23)25/h5-6,12H,2-4,7H2,1H3,(H2,19,24)(H2,20,21,22)/t12-/m1/s1.
What are the key properties of (5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide?
(5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide has a molecular weight of 359.36 g/mol, XLogP of 1.56, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-[14-fluoro-5-(methylamino)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-2-oxo-1,3-oxazolidine-5-carboxamide is sourced from PubChem (CID 58746357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).