4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one

C15H20N4O4S — CID 131684279

IUPAC4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one
SMILESO=C1COC2(COCCN(C(=O)c3csnn3)C2)CN1CC1CC1
InChIInChI=1S/C15H20N4O4S/c20-13-6-23-15(9-19(13)5-11-1-2-11)8-18(3-4-22-10-15)14(21)12-7-24-17-16-12/h7,11H,1-6,8-10H2
InChIKeyIUELFWRENJTYBL-UHFFFAOYSA-N
MW352.42 g/mol
LogP0.02
Rot. Bonds3

About 4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one

4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one (PubChem CID 131684279) has the molecular formula C15H20N4O4S and a molecular weight of 352.42 g/mol. Its IUPAC name is 4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one.

Molecular Properties

Compound Name4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one
PubChem CID131684279
Molecular FormulaC15H20N4O4S
Molecular Weight352.42 g/mol
Exact Mass352.12
IUPAC Name4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one
SMILESO=C1COC2(COCCN(C(=O)c3csnn3)C2)CN1CC1CC1
InChIInChI=1S/C15H20N4O4S/c20-13-6-23-15(9-19(13)5-11-1-2-11)8-18(3-4-22-10-15)14(21)12-7-24-17-16-12/h7,11H,1-6,8-10H2
InChIKeyIUELFWRENJTYBL-UHFFFAOYSA-N
XLogP0.02
TPSA84.86 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.42
LogP ≤ 50.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one 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

4-(cyclopropylmethyl)-8-(3-methylcyclobutanecarbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one
CID 131684237
4-(cyclopropylmethyl)-8-(4-methylcyclohexanecarbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one
CID 131684285
4-(cyclopropylmethyl)-8-pyrimidin-2-yl-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one
CID 131652382
4-(cyclopropylmethyl)-9-(1,3-thiazole-4-carbonyl)-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 97471430
(3-ethyl-1-oxa-7-azaspiro[4.4]nonan-7-yl)-(thiadiazol-4-yl)methanone
CID 131687649
1,4-dioxa-8-azaspiro[4.5]decan-8-yl(thiadiazol-4-yl)methanone
CID 47325499
8-(3,3-difluorocyclobutanecarbonyl)-4-ethyl-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one
CID 131685023
(2S)-N-cyclopentyl-2-methyl-4-(thiadiazole-4-carbonyl)morpholine-2-carboxamide
CID 92632665
8-(2-cyclopropylacetyl)-4-pyrimidin-5-yl-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one
CID 134077563
(8-pyrimidin-2-yl-1-oxa-4,8-diazaspiro[5.5]undecan-4-yl)-(thiadiazol-4-yl)methanone
CID 134074050
(4-chloropiperidin-1-yl)-(thiadiazol-4-yl)methanone
CID 65216412
[8-(cyclopropylmethyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]-pyridin-3-ylmethanone
CID 134072870

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one?
The IUPAC name of 4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one (CID 131684279) is 4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one.
What is the SMILES notation for 4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one?
The canonical SMILES for 4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one is O=C1COC2(COCCN(C(=O)c3csnn3)C2)CN1CC1CC1.
What is the InChIKey of 4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one?
The InChIKey is IUELFWRENJTYBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O4S/c20-13-6-23-15(9-19(13)5-11-1-2-11)8-18(3-4-22-10-15)14(21)12-7-24-17-16-12/h7,11H,1-6,8-10H2.
What are the key properties of 4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one?
4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one has a molecular weight of 352.42 g/mol, XLogP of 0.02, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylmethyl)-8-(thiadiazole-4-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-3-one is sourced from PubChem (CID 131684279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).