N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide

C17H25N5O2S — CID 155296563

IUPACN-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide
SMILESCCC1NC(c2ccc3c(c2)CC[C@H]3NC(=O)C2NNC(C)S2)NO1
InChIInChI=1S/C17H25N5O2S/c1-3-14-19-15(22-24-14)11-4-6-12-10(8-11)5-7-13(12)18-16(23)17-21-20-9(2)25-17/h4,6,8-9,13-15,17,19-22H,3,5,7H2,1-2H3,(H,18,23)/t9?,13-,14?,15?,17?/m1/s1
InChIKeyUHMFZSRHNUAKRT-HKECOMKXSA-N
MW363.49 g/mol
LogP1.16
Rot. Bonds4

About N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide

N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide (PubChem CID 155296563) has the molecular formula C17H25N5O2S and a molecular weight of 363.49 g/mol. Its IUPAC name is N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide
PubChem CID155296563
Molecular FormulaC17H25N5O2S
Molecular Weight363.49 g/mol
Exact Mass363.17
IUPAC NameN-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide
SMILESCCC1NC(c2ccc3c(c2)CC[C@H]3NC(=O)C2NNC(C)S2)NO1
InChIInChI=1S/C17H25N5O2S/c1-3-14-19-15(22-24-14)11-4-6-12-10(8-11)5-7-13(12)18-16(23)17-21-20-9(2)25-17/h4,6,8-9,13-15,17,19-22H,3,5,7H2,1-2H3,(H,18,23)/t9?,13-,14?,15?,17?/m1/s1
InChIKeyUHMFZSRHNUAKRT-HKECOMKXSA-N
XLogP1.16
TPSA86.45 Ų
H-Bond Donors5
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.49
LogP ≤ 51.16
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 107

Analyze N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide 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

N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide
CID 139425024
N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-(trifluoromethyl)-1,3-oxazolidine-5-carboxamide
CID 139425090
2-chloro-N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]piperidine-4-carboxamide
CID 139425087
N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-(1-hydroxyethyl)-1-azaspiro[5.8]tetradecane-2-carboxamide
CID 155296586
4-(hydroxymethyl)-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3-dihydro-1H-inden-1-yl]piperidine-2-carboxamide
CID 139425116
N-[(1R)-5-(5-ethyl-2-nonyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methyl-1,2-diazaspiro[5.9]pentadecane-5-carboxamide
CID 155296643
1-ethyl-N-[(1R)-5-(5-ethyl-2-nonyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-6-oxopyridine-3-carboxamide
CID 155296577
N-[(1S)-5-fluoro-2,3-dihydro-1H-inden-1-yl]cyclobutanecarboxamide
CID 94198795
N-[2-[[(1S)-5-fluoro-2,3-dihydro-1H-inden-1-yl]amino]-2-oxoethyl]propanamide
CID 94212219
1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-[(4-methylphenyl)methyl]urea
CID 60577386
3-amino-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)butanamide
CID 119745353
(3S)-1-ethyl-N-[(1R)-5-fluoro-2,3-dihydro-1H-inden-1-yl]-5-oxopyrrolidine-3-carboxamide
CID 94660919

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide?
The IUPAC name of N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide (CID 155296563) is N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide.
What is the SMILES notation for N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide?
The canonical SMILES for N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide is CCC1NC(c2ccc3c(c2)CC[C@H]3NC(=O)C2NNC(C)S2)NO1.
What is the InChIKey of N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide?
The InChIKey is UHMFZSRHNUAKRT-HKECOMKXSA-N. The full InChI is InChI=1S/C17H25N5O2S/c1-3-14-19-15(22-24-14)11-4-6-12-10(8-11)5-7-13(12)18-16(23)17-21-20-9(2)25-17/h4,6,8-9,13-15,17,19-22H,3,5,7H2,1-2H3,(H,18,23)/t9?,13-,14?,15?,17?/m1/s1.
What are the key properties of N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide?
N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide has a molecular weight of 363.49 g/mol, XLogP of 1.16, 4 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide is sourced from PubChem (CID 155296563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).