4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide

C9H14N4O2S — CID 83095925

IUPAC4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide
SMILESNC(=O)C1COCCN1Cc1cnc(N)s1
InChIInChI=1S/C9H14N4O2S/c10-8(14)7-5-15-2-1-13(7)4-6-3-12-9(11)16-6/h3,7H,1-2,4-5H2,(H2,10,14)(H2,11,12)
InChIKeyFWGYOHZDEUAZPL-UHFFFAOYSA-N
MW242.30 g/mol
LogP-0.59
Rot. Bonds3

About 4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide

4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide (PubChem CID 83095925) has the molecular formula C9H14N4O2S and a molecular weight of 242.30 g/mol. Its IUPAC name is 4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide.

Molecular Properties

Compound Name4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide
PubChem CID83095925
Molecular FormulaC9H14N4O2S
Molecular Weight242.30 g/mol
Exact Mass242.08
IUPAC Name4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide
SMILESNC(=O)C1COCCN1Cc1cnc(N)s1
InChIInChI=1S/C9H14N4O2S/c10-8(14)7-5-15-2-1-13(7)4-6-3-12-9(11)16-6/h3,7H,1-2,4-5H2,(H2,10,14)(H2,11,12)
InChIKeyFWGYOHZDEUAZPL-UHFFFAOYSA-N
XLogP-0.59
TPSA94.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-[(3-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine
CID 79772681
4-[(5-aminothiadiazol-4-yl)methyl]morpholine-3-carboxamide
CID 83096189
4-[(2-amino-4-pyridinyl)methyl]morpholine-3-carboxamide
CID 83095376
4-(pyridin-4-ylmethyl)morpholine-3-carboxamide
CID 132970427
4-[(6-amino-3-chloro-2-pyridinyl)methyl]morpholine-3-carboxamide
CID 83095377
4-[[4-(aminomethyl)phenyl]methyl]morpholine-3-carboxamide
CID 83101444
4-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]morpholine-3-carboxamide
CID 83095661
4-[(6-chloropyridazin-3-yl)methyl]morpholine-3-carboxamide
CID 104513819
4-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]morpholine-3-carboxamide
CID 83096013
4-[(2-chloro-4-pyridinyl)methyl]morpholine-3-carboxamide
CID 83092821
4-[(3-carbamoylmorpholin-4-yl)methyl]-5-methylthiophene-2-carboxylic acid
CID 83095890
5-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-ylmethyl)-1,3-thiazol-2-amine
CID 79772048

Frequently Asked Questions

What is the IUPAC name of 4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide?
The IUPAC name of 4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide (CID 83095925) is 4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide.
What is the SMILES notation for 4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide?
The canonical SMILES for 4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide is NC(=O)C1COCCN1Cc1cnc(N)s1.
What is the InChIKey of 4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide?
The InChIKey is FWGYOHZDEUAZPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2S/c10-8(14)7-5-15-2-1-13(7)4-6-3-12-9(11)16-6/h3,7H,1-2,4-5H2,(H2,10,14)(H2,11,12).
What are the key properties of 4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide?
4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide has a molecular weight of 242.30 g/mol, XLogP of -0.59, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-amino-1,3-thiazol-5-yl)methyl]morpholine-3-carboxamide is sourced from PubChem (CID 83095925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).