(2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide

C17H26N2O3 — CID 97383763

IUPAC(2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide
SMILESCc1ccc(CN2CCC3(CC[C@@H](C(=O)N(C)C)O3)CC2)o1
InChIInChI=1S/C17H26N2O3/c1-13-4-5-14(21-13)12-19-10-8-17(9-11-19)7-6-15(22-17)16(20)18(2)3/h4-5,15H,6-12H2,1-3H3/t15-/m0/s1
InChIKeyFSUQSDQSPGMOCI-HNNXBMFYSA-N
MW306.41 g/mol
LogP2.19
Rot. Bonds3

About (2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide

(2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide (PubChem CID 97383763) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is (2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide
PubChem CID97383763
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name(2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide
SMILESCc1ccc(CN2CCC3(CC[C@@H](C(=O)N(C)C)O3)CC2)o1
InChIInChI=1S/C17H26N2O3/c1-13-4-5-14(21-13)12-19-10-8-17(9-11-19)7-6-15(22-17)16(20)18(2)3/h4-5,15H,6-12H2,1-3H3/t15-/m0/s1
InChIKeyFSUQSDQSPGMOCI-HNNXBMFYSA-N
XLogP2.19
TPSA45.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide with MolForge

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Related Compounds

N,N-dimethyl-8-(thiophen-2-ylmethyl)-1-oxa-8-azaspiro[4.5]decane-2-carboxamide
CID 131657633
4-methyl-1-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxylic acid
CID 55179307
8-(2,5-dimethylfuran-3-carbonyl)-N,N-dimethyl-1-oxa-8-azaspiro[4.5]decane-2-carboxamide
CID 134076498
[4-methyl-1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methanol
CID 104695286
N,N-dimethyl-2-[(1S)-1'-[(5-methylfuran-2-yl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 97375833
3-[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]propanoic acid
CID 62218058
(3R)-8-[(5-methylfuran-2-yl)methyl]-3-propan-2-yl-1-oxa-8-azaspiro[4.5]decane
CID 97371264
(2S)-N,8-bis(furan-2-ylmethyl)-1-oxa-8-azaspiro[4.5]decane-2-carboxamide
CID 97422219
3-methoxy-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane;2,2,2-trifluoroacetic acid
CID 155855672
2-[(5-methylfuran-2-yl)methyl]-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol
CID 81115351
(3aS,6aS)-N,N,2-trimethyl-1'-[(5-methylfuran-2-yl)methyl]spiro[3,4,5,6a-tetrahydro-1H-cyclopenta[c]pyrrole-6,4'-piperidine]-3a-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 155841005
N,N-dimethyl-1-[(2R,5R)-7-[(5-methylfuran-2-yl)methyl]-1,10-dioxa-7-azaspiro[4.6]undecan-2-yl]methanamine
CID 97375448

Frequently Asked Questions

What is the IUPAC name of (2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide?
The IUPAC name of (2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide (CID 97383763) is (2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide.
What is the SMILES notation for (2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide?
The canonical SMILES for (2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide is Cc1ccc(CN2CCC3(CC[C@@H](C(=O)N(C)C)O3)CC2)o1.
What is the InChIKey of (2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide?
The InChIKey is FSUQSDQSPGMOCI-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-13-4-5-14(21-13)12-19-10-8-17(9-11-19)7-6-15(22-17)16(20)18(2)3/h4-5,15H,6-12H2,1-3H3/t15-/m0/s1.
What are the key properties of (2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide?
(2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide has a molecular weight of 306.41 g/mol, XLogP of 2.19, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N,N-dimethyl-8-[(5-methylfuran-2-yl)methyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide is sourced from PubChem (CID 97383763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).