2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide

C18H22N2O4 — CID 126436675

IUPAC2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide
SMILESO=C1OCC2(CCN(C(=O)N[C@@H]3CCCc4ccccc43)CC2)O1
InChIInChI=1S/C18H22N2O4/c21-16(19-15-7-3-5-13-4-1-2-6-14(13)15)20-10-8-18(9-11-20)12-23-17(22)24-18/h1-2,4,6,15H,3,5,7-12H2,(H,19,21)/t15-/m1/s1
InChIKeySYDHRGGKXMPFPS-OAHLLOKOSA-N
MW330.38 g/mol
LogP2.78
Rot. Bonds1

About 2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide

2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide (PubChem CID 126436675) has the molecular formula C18H22N2O4 and a molecular weight of 330.38 g/mol. Its IUPAC name is 2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound Name2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide
PubChem CID126436675
Molecular FormulaC18H22N2O4
Molecular Weight330.38 g/mol
Exact Mass330.16
IUPAC Name2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide
SMILESO=C1OCC2(CCN(C(=O)N[C@@H]3CCCc4ccccc43)CC2)O1
InChIInChI=1S/C18H22N2O4/c21-16(19-15-7-3-5-13-4-1-2-6-14(13)15)20-10-8-18(9-11-20)12-23-17(22)24-18/h1-2,4,6,15H,3,5,7-12H2,(H,19,21)/t15-/m1/s1
InChIKeySYDHRGGKXMPFPS-OAHLLOKOSA-N
XLogP2.78
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.38
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide
CID 54412767
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]morpholine-4-carboxamide
CID 40653878
3-hydroxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-1-carboxamide
CID 110882568
1-N-[(5R)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl]piperidine-1,4-dicarboxamide
CID 95351345
4-(1,2-oxazol-3-ylmethyl)-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]piperazine-1-carboxamide
CID 95907905
N-[(3S)-1-benzylpiperidin-3-yl]-2-oxo-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide;formic acid
CID 154910180
1-acetyl-4-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]piperidine-4-carboxamide
CID 39897380
N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl fluoride
CID 90147743
2-oxo-2-piperazin-1-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 62318149
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 51957654
N-(2,3-dihydro-1H-inden-1-yl)-3-hydroxypiperidine-1-carboxamide
CID 110882685
3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)oxetane-3-carboxamide
CID 146022448

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
The IUPAC name of 2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide (CID 126436675) is 2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for 2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for 2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide is O=C1OCC2(CCN(C(=O)N[C@@H]3CCCc4ccccc43)CC2)O1.
What is the InChIKey of 2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
The InChIKey is SYDHRGGKXMPFPS-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H22N2O4/c21-16(19-15-7-3-5-13-4-1-2-6-14(13)15)20-10-8-18(9-11-20)12-23-17(22)24-18/h1-2,4,6,15H,3,5,7-12H2,(H,19,21)/t15-/m1/s1.
What are the key properties of 2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide has a molecular weight of 330.38 g/mol, XLogP of 2.78, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 126436675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).