2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide

C14H22N4O2S — CID 71986645

IUPAC2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(CN(CC1CCCO1)C1CCCC1)Nc1nncs1
InChIInChI=1S/C14H22N4O2S/c19-13(16-14-17-15-10-21-14)9-18(11-4-1-2-5-11)8-12-6-3-7-20-12/h10-12H,1-9H2,(H,16,17,19)
InChIKeyGDELNUVZHYTUEI-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.90
Rot. Bonds6

About 2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide

2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 71986645) has the molecular formula C14H22N4O2S and a molecular weight of 310.42 g/mol. Its IUPAC name is 2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide
PubChem CID71986645
Molecular FormulaC14H22N4O2S
Molecular Weight310.42 g/mol
Exact Mass310.15
IUPAC Name2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(CN(CC1CCCO1)C1CCCC1)Nc1nncs1
InChIInChI=1S/C14H22N4O2S/c19-13(16-14-17-15-10-21-14)9-18(11-4-1-2-5-11)8-12-6-3-7-20-12/h10-12H,1-9H2,(H,16,17,19)
InChIKeyGDELNUVZHYTUEI-UHFFFAOYSA-N
XLogP1.90
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[cyclohexyl(methyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 22200514
1-benzyl-1-[[(2S)-oxolan-2-yl]methyl]-3-(1,3,4-thiadiazol-2-yl)urea
CID 94503656
N'-cycloheptyl-N'-methyl-N-(1,3,4-thiadiazol-2-yl)butanediamide
CID 56755534
N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-N-(oxolan-2-ylmethyl)propanamide
CID 5184376
2-[(1,1-dioxothiolan-3-yl)-(oxolan-2-ylmethyl)amino]-N-phenylacetamide
CID 164663511
2-(oxolan-2-ylmethoxy)-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 46445892
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-(oxolan-2-ylmethyl)thiophene-2-carboxamide
CID 42771679
2,2-dimethyl-N-(oxolan-2-ylmethyl)-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]propanamide
CID 4582238
1-N-(oxolan-2-ylmethyl)-3-N-(1,3,4-thiadiazol-2-yl)piperidine-1,3-dicarboxamide
CID 56807058
2-[(1,1-dioxothiolan-3-yl)-(oxolan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide
CID 164663354
2-[methyl(oxan-2-ylmethyl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 86825120
2-(diethylamino)-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 47123067

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide (CID 71986645) is 2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide is O=C(CN(CC1CCCO1)C1CCCC1)Nc1nncs1.
What is the InChIKey of 2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is GDELNUVZHYTUEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2S/c19-13(16-14-17-15-10-21-14)9-18(11-4-1-2-5-11)8-12-6-3-7-20-12/h10-12H,1-9H2,(H,16,17,19).
What are the key properties of 2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide?
2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 310.42 g/mol, XLogP of 1.90, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(oxolan-2-ylmethyl)amino]-N-(1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 71986645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).