2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide

C14H21N3O2S — CID 50960786

IUPAC2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)N[C@H]2COC[C@@H]2N2CCCCC2)cs1
InChIInChI=1S/C14H21N3O2S/c1-10-15-12(9-20-10)14(18)16-11-7-19-8-13(11)17-5-3-2-4-6-17/h9,11,13H,2-8H2,1H3,(H,16,18)/t11-,13-/m0/s1
InChIKeyBENDUOGGGFFFBJ-AAEUAGOBSA-N
MW295.41 g/mol
LogP1.43
Rot. Bonds3

About 2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide

2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide (PubChem CID 50960786) has the molecular formula C14H21N3O2S and a molecular weight of 295.41 g/mol. Its IUPAC name is 2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide
PubChem CID50960786
Molecular FormulaC14H21N3O2S
Molecular Weight295.41 g/mol
Exact Mass295.14
IUPAC Name2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)N[C@H]2COC[C@@H]2N2CCCCC2)cs1
InChIInChI=1S/C14H21N3O2S/c1-10-15-12(9-20-10)14(18)16-11-7-19-8-13(11)17-5-3-2-4-6-17/h9,11,13H,2-8H2,1H3,(H,16,18)/t11-,13-/m0/s1
InChIKeyBENDUOGGGFFFBJ-AAEUAGOBSA-N
XLogP1.43
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide with MolForge

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Related Compounds

(4-Isopropyl-piperazin-1-yl)-(2-morpholin-4-ylmethylthiazol-4-yl)-methanone
CID 11530172
(4-Isopropyl-piperazin-1-yl)-{2-[(2-methoxy-ethylamino)-methyl]-thiazol-4-yl}-methanone
CID 11558917
Ethyl 4-[[4-(2-methylpropanoylamino)piperidin-1-yl]methyl]-1,3-thiazole-2-carboxylate
CID 51087087
N-[(3R,4R)-4-(4-methylpiperazin-1-yl)oxolan-3-yl]-2-propyl-1,3-thiazole-4-carboxamide
CID 72933096
N-[(3S,3aS,7aS)-1-acetyl-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrol-3-yl]-1,3-thiazole-4-carboxamide
CID 97460459
N-[(3S,3aS,7aS)-1-methyl-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrol-3-yl]-1,3-thiazole-4-carboxamide
CID 98777443
2-[(2R,4S)-4-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]oxan-2-yl]-N-propan-2-yl-1,3-thiazole-4-carboxamide
CID 122193418
2-[(2R,4S)-4-[[(2S,3S)-2-(dimethylamino)-3-methylpentanoyl]amino]oxan-2-yl]-N-propan-2-yl-1,3-thiazole-4-carboxamide
CID 122193420
2-[(2R,4S)-4-[[(2S,3S)-2-[[2-(dimethylamino)acetyl]amino]-3-methylpentanoyl]amino]oxan-2-yl]-N-propan-2-yl-1,3-thiazole-4-carboxamide
CID 122193422
2-(2-hydroxyethoxymethyl)-N-propan-2-yl-1,3-thiazole-4-carboxamide
CID 49792699
Ethyl 1-[(2-propyl-1,3-thiazol-4-yl)carbonyl]piperidine-2-carboxylate
CID 50970699
2-methyl-N-[3-[(3S)-3-methylpiperidin-1-yl]propyl]-1,3-thiazole-4-carboxamide
CID 52317008

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide (CID 50960786) is 2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide is Cc1nc(C(=O)N[C@H]2COC[C@@H]2N2CCCCC2)cs1.
What is the InChIKey of 2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide?
The InChIKey is BENDUOGGGFFFBJ-AAEUAGOBSA-N. The full InChI is InChI=1S/C14H21N3O2S/c1-10-15-12(9-20-10)14(18)16-11-7-19-8-13(11)17-5-3-2-4-6-17/h9,11,13H,2-8H2,1H3,(H,16,18)/t11-,13-/m0/s1.
What are the key properties of 2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide?
2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide has a molecular weight of 295.41 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 50960786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).