2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone

C15H22N2O2S — CID 82038139

IUPAC2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone
SMILESCOc1ccsc1C(=O)N1CCCC2(CCCNC2)C1
InChIInChI=1S/C15H22N2O2S/c1-19-12-4-9-20-13(12)14(18)17-8-3-6-15(11-17)5-2-7-16-10-15/h4,9,16H,2-3,5-8,10-11H2,1H3
InChIKeyYNWWNKDXSKTOCH-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.36
Rot. Bonds2

About 2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone

2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone (PubChem CID 82038139) has the molecular formula C15H22N2O2S and a molecular weight of 294.42 g/mol. Its IUPAC name is 2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone.

Molecular Properties

Compound Name2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone
PubChem CID82038139
Molecular FormulaC15H22N2O2S
Molecular Weight294.42 g/mol
Exact Mass294.14
IUPAC Name2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone
SMILESCOc1ccsc1C(=O)N1CCCC2(CCCNC2)C1
InChIInChI=1S/C15H22N2O2S/c1-19-12-4-9-20-13(12)14(18)17-8-3-6-15(11-17)5-2-7-16-10-15/h4,9,16H,2-3,5-8,10-11H2,1H3
InChIKeyYNWWNKDXSKTOCH-UHFFFAOYSA-N
XLogP2.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Methoxy-N-[2-(4-morpholinyl)ethyl]-2-thiophenecarboxamide
CID 4353651
N-[3-[benzyl(methyl)amino]-3-oxopropyl]-3-methoxy-5-methylthiophene-2-carboxamide
CID 72014818
N-[(2-hydroxy-1-methylcyclohexyl)methyl]-3-methoxythiophene-2-carboxamide
CID 71979691
N-(2-cyanoethyl)-N-(2,2-dimethylpropyl)-3-methoxythiophene-2-carboxamide
CID 72013469
N-(2-carbamoylcyclopentyl)-3-methoxythiophene-2-carboxamide
CID 72116228
N-[(2S,3R)-2-tert-butyl-6-oxopiperidin-3-yl]-3-methoxythiophene-2-carboxamide
CID 126812967
N-cyclopropyl-1-[3-(difluoromethoxy)thiophene-2-carbonyl]piperidine-3-carboxamide
CID 53582994
N-[1-[3-(difluoromethoxy)thiophene-2-carbonyl]piperidin-3-yl]-2-methylpropanamide
CID 53607631
3-(difluoromethoxy)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide
CID 53609252
3-(difluoromethoxy)-N-[1-(4-methylbenzoyl)piperidin-4-yl]thiophene-2-carboxamide
CID 60257847
3-(difluoromethoxy)-N-[[3-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]thiophene-2-carboxamide
CID 60257917
3-Azaspiro[5.5]undecan-3-yl-[3-(difluoromethoxy)thiophen-2-yl]methanone
CID 60257950

Frequently Asked Questions

What is the IUPAC name of 2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone?
The IUPAC name of 2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone (CID 82038139) is 2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone.
What is the SMILES notation for 2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone?
The canonical SMILES for 2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone is COc1ccsc1C(=O)N1CCCC2(CCCNC2)C1.
What is the InChIKey of 2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone?
The InChIKey is YNWWNKDXSKTOCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2S/c1-19-12-4-9-20-13(12)14(18)17-8-3-6-15(11-17)5-2-7-16-10-15/h4,9,16H,2-3,5-8,10-11H2,1H3.
What are the key properties of 2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone?
2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone has a molecular weight of 294.42 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-diazaspiro[5.5]undecan-2-yl-(3-methoxythiophen-2-yl)methanone is sourced from PubChem (CID 82038139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).