(3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide

C10H16N4O2S — CID 99831664

IUPAC(3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide
SMILESCCOC[C@@H]1CCN(C(=O)Nc2cnns2)C1
InChIInChI=1S/C10H16N4O2S/c1-2-16-7-8-3-4-14(6-8)10(15)12-9-5-11-13-17-9/h5,8H,2-4,6-7H2,1H3,(H,12,15)/t8-/m1/s1
InChIKeyGBNNHVCDKFONOP-MRVPVSSYSA-N
MW256.33 g/mol
LogP1.43
Rot. Bonds4

About (3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide

(3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide (PubChem CID 99831664) has the molecular formula C10H16N4O2S and a molecular weight of 256.33 g/mol. Its IUPAC name is (3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide
PubChem CID99831664
Molecular FormulaC10H16N4O2S
Molecular Weight256.33 g/mol
Exact Mass256.10
IUPAC Name(3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide
SMILESCCOC[C@@H]1CCN(C(=O)Nc2cnns2)C1
InChIInChI=1S/C10H16N4O2S/c1-2-16-7-8-3-4-14(6-8)10(15)12-9-5-11-13-17-9/h5,8H,2-4,6-7H2,1H3,(H,12,15)/t8-/m1/s1
InChIKeyGBNNHVCDKFONOP-MRVPVSSYSA-N
XLogP1.43
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3S)-3-(piperidin-1-ylmethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide
CID 99836083
(3S)-3-(ethoxymethyl)-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrrolidine-1-carboxamide
CID 97029592
3-(ethoxymethyl)-N-[(3-methylimidazol-4-yl)methyl]pyrrolidine-1-carboxamide
CID 139004590
3-(ethoxymethyl)pyrrolidine-1-carbonyl chloride
CID 165496688
N-[2-(2,2-difluoroethoxy)phenyl]-3-(ethoxymethyl)pyrrolidine-1-carboxamide
CID 71849484
4-[[2,3-difluoro-4-(trifluoromethyl)phenyl]sulfonylmethyl]-N-(thiadiazol-5-yl)piperidine-1-carboxamide
CID 122484410
[(1R,5S)-6-bicyclo[3.1.0]hexanyl]-[(3S)-3-(ethoxymethyl)pyrrolidin-1-yl]methanone
CID 97100937
3-(ethoxymethyl)-N-(4-ethyl-3-nitrophenyl)pyrrolidine-1-carboxamide
CID 75376309
(3S)-3-(ethoxymethyl)-N-[(1S)-1-(1,3-thiazol-2-yl)ethyl]piperidine-1-carboxamide
CID 95905079
ethyl N-(thiadiazol-5-yl)carbamate
CID 12707508
(3S)-3-(ethoxymethyl)-N-[(3S)-1-(1-methylpyrazol-4-yl)piperidin-3-yl]pyrrolidine-1-carboxamide
CID 96569286
(2S)-2-amino-1-[3-(ethoxymethyl)pyrrolidin-1-yl]butan-1-one;hydrochloride
CID 119341199

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide?
The IUPAC name of (3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide (CID 99831664) is (3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for (3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for (3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide is CCOC[C@@H]1CCN(C(=O)Nc2cnns2)C1.
What is the InChIKey of (3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide?
The InChIKey is GBNNHVCDKFONOP-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H16N4O2S/c1-2-16-7-8-3-4-14(6-8)10(15)12-9-5-11-13-17-9/h5,8H,2-4,6-7H2,1H3,(H,12,15)/t8-/m1/s1.
What are the key properties of (3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide?
(3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide has a molecular weight of 256.33 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(ethoxymethyl)-N-(thiadiazol-5-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 99831664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).