N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide

C23H23N5O4 — CID 10002973

IUPACN-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NC[C@H]1CN(c2ccc3c(c2)CCCc2c(-c4cc[nH]c(=O)c4)n[nH]c2-3)C(=O)O1
InChIInChI=1S/C23H23N5O4/c1-13(29)25-11-17-12-28(23(31)32-17)16-5-6-18-14(9-16)3-2-4-19-21(26-27-22(18)19)15-7-8-24-20(30)10-15/h5-10,17H,2-4,11-12H2,1H3,(H,24,30)(H,25,29)(H,26,27)/t17-/m0/s1
InChIKeyQHOWUPCXLXWSBE-KRWDZBQOSA-N
MW433.47 g/mol
LogP2.38
Rot. Bonds4

About N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide

N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide (PubChem CID 10002973) has the molecular formula C23H23N5O4 and a molecular weight of 433.47 g/mol. Its IUPAC name is N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide
PubChem CID10002973
Molecular FormulaC23H23N5O4
Molecular Weight433.47 g/mol
Exact Mass433.18
IUPAC NameN-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NC[C@H]1CN(c2ccc3c(c2)CCCc2c(-c4cc[nH]c(=O)c4)n[nH]c2-3)C(=O)O1
InChIInChI=1S/C23H23N5O4/c1-13(29)25-11-17-12-28(23(31)32-17)16-5-6-18-14(9-16)3-2-4-19-21(26-27-22(18)19)15-7-8-24-20(30)10-15/h5-10,17H,2-4,11-12H2,1H3,(H,24,30)(H,25,29)(H,26,27)/t17-/m0/s1
InChIKeyQHOWUPCXLXWSBE-KRWDZBQOSA-N
XLogP2.38
TPSA120.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.47
LogP ≤ 52.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide with MolForge

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Related Compounds

N-[[(5S)-2-oxo-3-(5-thiophen-3-yl-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl)-1,3-oxazolidin-5-yl]methyl]acetamide
CID 10477334
N-[[(5S)-3-[5-(4-hydroxyfuran-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 10002335
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
N-[[(5S)-2-oxo-3-[5-[2-(trifluoromethoxy)phenyl]-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide
CID 10481092
N-[[(5S)-2-oxo-3-[5-[4-(trifluoromethoxy)furan-3-yl]-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide
CID 10458281
N-[[(5S)-3-[5-(2-fluoro-4-pyridinyl)-3-oxa-4-azatricyclo[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 10365728
N-[[(5S)-3-[(6Z)-6-(dimethylaminomethylidene)-5-oxo-8,9-dihydro-7H-benzo[7]annulen-2-yl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 10406909
N-[[(5S)-2-oxo-3-[(6Z)-5-oxo-6-(pyridin-4-ylmethylidene)-8,9-dihydro-7H-benzo[7]annulen-2-yl]-1,3-oxazolidin-5-yl]methyl]acetamide
CID 10319093
N-[[3-[6-[(Z)-3-amino-2-aminosulfanylbut-2-enoyl]-5-oxo-6,7,8,9-tetrahydrobenzo[7]annulen-2-yl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 142929355
N-[[(5S)-3-[5-(3-methoxy-4-pyridinyl)-3-oxa-4-azatricyclo[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
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CID 14987746
N-[[3-(3,4-dimethylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 20666078

Frequently Asked Questions

What is the IUPAC name of N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The IUPAC name of N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide (CID 10002973) is N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide.
What is the SMILES notation for N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The canonical SMILES for N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide is CC(=O)NC[C@H]1CN(c2ccc3c(c2)CCCc2c(-c4cc[nH]c(=O)c4)n[nH]c2-3)C(=O)O1.
What is the InChIKey of N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The InChIKey is QHOWUPCXLXWSBE-KRWDZBQOSA-N. The full InChI is InChI=1S/C23H23N5O4/c1-13(29)25-11-17-12-28(23(31)32-17)16-5-6-18-14(9-16)3-2-4-19-21(26-27-22(18)19)15-7-8-24-20(30)10-15/h5-10,17H,2-4,11-12H2,1H3,(H,24,30)(H,25,29)(H,26,27)/t17-/m0/s1.
What are the key properties of N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide?
N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide has a molecular weight of 433.47 g/mol, XLogP of 2.38, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(5S)-2-oxo-3-[5-(2-oxo-1H-pyridin-4-yl)-3,4-diazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaen-12-yl]-1,3-oxazolidin-5-yl]methyl]acetamide is sourced from PubChem (CID 10002973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).