3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide

C18H32N4O5 — CID 153424059

IUPAC3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide
SMILESCOCC1NC(C2CCC3C(CC[C@H]3NC(=O)C3CC(OC)NO3)C2)NO1
InChIInChI=1S/C18H32N4O5/c1-24-9-16-20-17(22-27-16)11-3-5-12-10(7-11)4-6-13(12)19-18(23)14-8-15(25-2)21-26-14/h10-17,20-22H,3-9H2,1-2H3,(H,19,23)/t10?,11?,12?,13-,14?,15?,16?,17?/m1/s1
InChIKeyDYNRGGVNKRNUGK-LFWZRRHXSA-N
MW384.48 g/mol
LogP-0.01
Rot. Bonds6

About 3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide

3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide (PubChem CID 153424059) has the molecular formula C18H32N4O5 and a molecular weight of 384.48 g/mol. Its IUPAC name is 3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide
PubChem CID153424059
Molecular FormulaC18H32N4O5
Molecular Weight384.48 g/mol
Exact Mass384.24
IUPAC Name3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide
SMILESCOCC1NC(C2CCC3C(CC[C@H]3NC(=O)C3CC(OC)NO3)C2)NO1
InChIInChI=1S/C18H32N4O5/c1-24-9-16-20-17(22-27-16)11-3-5-12-10(7-11)4-6-13(12)19-18(23)14-8-15(25-2)21-26-14/h10-17,20-22H,3-9H2,1-2H3,(H,19,23)/t10?,11?,12?,13-,14?,15?,16?,17?/m1/s1
InChIKeyDYNRGGVNKRNUGK-LFWZRRHXSA-N
XLogP-0.01
TPSA102.11 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 5-0.01
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Analyze 3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide?
The IUPAC name of 3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide (CID 153424059) is 3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide.
What is the SMILES notation for 3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide?
The canonical SMILES for 3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide is COCC1NC(C2CCC3C(CC[C@H]3NC(=O)C3CC(OC)NO3)C2)NO1.
What is the InChIKey of 3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide?
The InChIKey is DYNRGGVNKRNUGK-LFWZRRHXSA-N. The full InChI is InChI=1S/C18H32N4O5/c1-24-9-16-20-17(22-27-16)11-3-5-12-10(7-11)4-6-13(12)19-18(23)14-8-15(25-2)21-26-14/h10-17,20-22H,3-9H2,1-2H3,(H,19,23)/t10?,11?,12?,13-,14?,15?,16?,17?/m1/s1.
What are the key properties of 3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide?
3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide has a molecular weight of 384.48 g/mol, XLogP of -0.01, 6 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-1,2-oxazolidine-5-carboxamide is sourced from PubChem (CID 153424059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).