4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide

C18H30N4O2S — CID 92627062

IUPAC4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide
SMILESCc1nc(N2CCCC2)sc1C(=O)NC[C@@H](C(C)C)N1CCOCC1
InChIInChI=1S/C18H30N4O2S/c1-13(2)15(21-8-10-24-11-9-21)12-19-17(23)16-14(3)20-18(25-16)22-6-4-5-7-22/h13,15H,4-12H2,1-3H3,(H,19,23)/t15-/m0/s1
InChIKeyWKRWAHDSFQVRJM-HNNXBMFYSA-N
MW366.53 g/mol
LogP2.14
Rot. Bonds6

About 4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide

4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide (PubChem CID 92627062) has the molecular formula C18H30N4O2S and a molecular weight of 366.53 g/mol. Its IUPAC name is 4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide
PubChem CID92627062
Molecular FormulaC18H30N4O2S
Molecular Weight366.53 g/mol
Exact Mass366.21
IUPAC Name4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide
SMILESCc1nc(N2CCCC2)sc1C(=O)NC[C@@H](C(C)C)N1CCOCC1
InChIInChI=1S/C18H30N4O2S/c1-13(2)15(21-8-10-24-11-9-21)12-19-17(23)16-14(3)20-18(25-16)22-6-4-5-7-22/h13,15H,4-12H2,1-3H3,(H,19,23)/t15-/m0/s1
InChIKeyWKRWAHDSFQVRJM-HNNXBMFYSA-N
XLogP2.14
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.53
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide with MolForge

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Related Compounds

4-methyl-N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]-3-pyrrolidin-1-ylbenzamide
CID 92626833
N-tert-butyl-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carboxamide
CID 154568714
2-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)benzamide
CID 110402733
4-amino-2-pyrrolidin-1-yl-N-(2,3,3-trimethylbutyl)-1,3-thiazole-5-carboxamide
CID 116672281
2-benzyl-N-(3-ethyl-2-morpholin-4-ylpentyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 46439822
4-methyl-N-[[(2S,5R)-1-methyl-5-[2-(methylamino)-2-oxoethyl]pyrrolidin-2-yl]methyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide
CID 166624227
ethyl N-[3-methyl-1-[2-(4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbonyl)hydrazinyl]-1-oxobutan-2-yl]carbamate
CID 55644563
4-[(4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 157011581
2-methyl-N-[4-methyl-1-[2-(4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbonyl)hydrazinyl]-1-oxopentan-2-yl]benzamide
CID 46798212
4-methyl-2-morpholin-4-yl-N-(2-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide
CID 154570012
1-heptan-2-yl-3-[(4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbonyl)amino]urea
CID 46486050
3-methyl-N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]-1-[(4-methylphenyl)methyl]thieno[3,2-d]pyrazole-5-carboxamide
CID 25470437

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide (CID 92627062) is 4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide is Cc1nc(N2CCCC2)sc1C(=O)NC[C@@H](C(C)C)N1CCOCC1.
What is the InChIKey of 4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide?
The InChIKey is WKRWAHDSFQVRJM-HNNXBMFYSA-N. The full InChI is InChI=1S/C18H30N4O2S/c1-13(2)15(21-8-10-24-11-9-21)12-19-17(23)16-14(3)20-18(25-16)22-6-4-5-7-22/h13,15H,4-12H2,1-3H3,(H,19,23)/t15-/m0/s1.
What are the key properties of 4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide?
4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide has a molecular weight of 366.53 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 92627062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).