N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide

C14H19N3O2S — CID 138033026

IUPACN-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide
SMILESO=C(Nc1nc2c(s1)CCC2)C1NCC12CCOCC2
InChIInChI=1S/C14H19N3O2S/c18-12(11-14(8-15-11)4-6-19-7-5-14)17-13-16-9-2-1-3-10(9)20-13/h11,15H,1-8H2,(H,16,17,18)
InChIKeyVAFNJABVODQDEX-UHFFFAOYSA-N
MW293.39 g/mol
LogP1.34
Rot. Bonds2

About N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide

N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide (PubChem CID 138033026) has the molecular formula C14H19N3O2S and a molecular weight of 293.39 g/mol. Its IUPAC name is N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide.

Molecular Properties

Compound NameN-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide
PubChem CID138033026
Molecular FormulaC14H19N3O2S
Molecular Weight293.39 g/mol
Exact Mass293.12
IUPAC NameN-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide
SMILESO=C(Nc1nc2c(s1)CCC2)C1NCC12CCOCC2
InChIInChI=1S/C14H19N3O2S/c18-12(11-14(8-15-11)4-6-19-7-5-14)17-13-16-9-2-1-3-10(9)20-13/h11,15H,1-8H2,(H,16,17,18)
InChIKeyVAFNJABVODQDEX-UHFFFAOYSA-N
XLogP1.34
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide
CID 167796502
3-amino-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)oxolane-3-carboxamide
CID 64893407
4-(aminomethyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)oxane-4-carboxamide
CID 115439503
N-(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,3]thiazol-2-yl)morpholine-3-carboxamide
CID 119700429
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamoyl)cyclopropane-1-carboxylic acid
CID 62095264
N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)oxolane-3-carboxamide
CID 56675559
1-amino-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)cyclobutane-1-carboxamide
CID 81168772
(2S)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 119290959
N-(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,3]thiazol-2-yl)pyrrolidine-2-carboxamide
CID 102554241
N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,3-thiazolidine-4-carboxamide
CID 54968780
N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)piperidine-2-carboxamide
CID 54968732
(3S,4S)-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylpyrrolidine-3-carboxamide
CID 98540107

Frequently Asked Questions

What is the IUPAC name of N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide?
The IUPAC name of N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide (CID 138033026) is N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide.
What is the SMILES notation for N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide?
The canonical SMILES for N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide is O=C(Nc1nc2c(s1)CCC2)C1NCC12CCOCC2.
What is the InChIKey of N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide?
The InChIKey is VAFNJABVODQDEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S/c18-12(11-14(8-15-11)4-6-19-7-5-14)17-13-16-9-2-1-3-10(9)20-13/h11,15H,1-8H2,(H,16,17,18).
What are the key properties of N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide?
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide has a molecular weight of 293.39 g/mol, XLogP of 1.34, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-7-oxa-2-azaspiro[3.5]nonane-3-carboxamide is sourced from PubChem (CID 138033026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).