2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide

C9H15N3O2S — CID 62794301

IUPAC2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide
SMILESCOCCN(C)C(=O)c1sc(N)nc1C
InChIInChI=1S/C9H15N3O2S/c1-6-7(15-9(10)11-6)8(13)12(2)4-5-14-3/h4-5H2,1-3H3,(H2,10,11)
InChIKeyHVVNVMQCMHGTSQ-UHFFFAOYSA-N
MW229.30 g/mol
LogP0.75
Rot. Bonds4

About 2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide

2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide (PubChem CID 62794301) has the molecular formula C9H15N3O2S and a molecular weight of 229.30 g/mol. Its IUPAC name is 2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide
PubChem CID62794301
Molecular FormulaC9H15N3O2S
Molecular Weight229.30 g/mol
Exact Mass229.09
IUPAC Name2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide
SMILESCOCCN(C)C(=O)c1sc(N)nc1C
InChIInChI=1S/C9H15N3O2S/c1-6-7(15-9(10)11-6)8(13)12(2)4-5-14-3/h4-5H2,1-3H3,(H2,10,11)
InChIKeyHVVNVMQCMHGTSQ-UHFFFAOYSA-N
XLogP0.75
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide (CID 62794301) is 2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide is COCCN(C)C(=O)c1sc(N)nc1C.
What is the InChIKey of 2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide?
The InChIKey is HVVNVMQCMHGTSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2S/c1-6-7(15-9(10)11-6)8(13)12(2)4-5-14-3/h4-5H2,1-3H3,(H2,10,11).
What are the key properties of 2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide?
2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide has a molecular weight of 229.30 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methoxyethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 62794301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).