[1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone

C15H22N2O2S — CID 97399212

IUPAC[1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone
SMILESCOCCN1CCC12CCN(C(=O)c1ccsc1)CC2
InChIInChI=1S/C15H22N2O2S/c1-19-10-9-17-8-5-15(17)3-6-16(7-4-15)14(18)13-2-11-20-12-13/h2,11-12H,3-10H2,1H3
InChIKeyMVJIZWKCRKPMKW-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.08
Rot. Bonds4

About [1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone

[1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone (PubChem CID 97399212) has the molecular formula C15H22N2O2S and a molecular weight of 294.42 g/mol. Its IUPAC name is [1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone.

Molecular Properties

Compound Name[1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone
PubChem CID97399212
Molecular FormulaC15H22N2O2S
Molecular Weight294.42 g/mol
Exact Mass294.14
IUPAC Name[1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone
SMILESCOCCN1CCC12CCN(C(=O)c1ccsc1)CC2
InChIInChI=1S/C15H22N2O2S/c1-19-10-9-17-8-5-15(17)3-6-16(7-4-15)14(18)13-2-11-20-12-13/h2,11-12H,3-10H2,1H3
InChIKeyMVJIZWKCRKPMKW-UHFFFAOYSA-N
XLogP2.08
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3-Morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone
CID 24817426
(1-Ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)-thiophen-3-ylmethanone
CID 97396263
(1-Ethyl-1,8-diazaspiro[4.5]decan-8-yl)-thiophen-3-ylmethanone
CID 97493554
(1-Ethyl-1,7-diazaspiro[3.4]octan-7-yl)-thiophen-3-ylmethanone
CID 118742675
N-((1-(2-methoxyethyl)piperidin-4-yl)methyl)thiophene-3-carboxamide
CID 45558601
N-[1-(2-Methoxyethyl)piperidin-4-YL]thiophene-3-carboxamide
CID 47549497
4-(2-Methoxyethyl)-1-(thiophene-3-carbonyl)piperidine
CID 53150842
4-{2-[1-(Thiophene-3-carbonyl)piperidin-2-YL]ethyl}morpholine
CID 53193439
N-(4-morpholinobut-2-yn-1-yl)thiophene-3-carboxamide
CID 71792704
(3-(Morpholinomethyl)-1,4-thiazepan-4-yl)(thiophen-3-yl)methanone
CID 71801887
2-methoxy-N-tetrahydro-2H-pyran-4-yl-N-[1-(3-thienylcarbonyl)-4-piperidyl]acetamide
CID 91916254
1-(2-Methoxyethyl)-3-[4-(3-thienylcarbonyl)piperazino]-2-pyrrolidinone
CID 91925727

Frequently Asked Questions

What is the IUPAC name of [1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone?
The IUPAC name of [1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone (CID 97399212) is [1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone.
What is the SMILES notation for [1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone?
The canonical SMILES for [1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone is COCCN1CCC12CCN(C(=O)c1ccsc1)CC2.
What is the InChIKey of [1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone?
The InChIKey is MVJIZWKCRKPMKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2S/c1-19-10-9-17-8-5-15(17)3-6-16(7-4-15)14(18)13-2-11-20-12-13/h2,11-12H,3-10H2,1H3.
What are the key properties of [1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone?
[1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone has a molecular weight of 294.42 g/mol, XLogP of 2.08, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methoxyethyl)-1,7-diazaspiro[3.5]nonan-7-yl]-thiophen-3-ylmethanone is sourced from PubChem (CID 97399212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).