N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide

C10H16N2O2S — CID 65199061

IUPACN-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)N(CCO)C(C)C)cs1
InChIInChI=1S/C10H16N2O2S/c1-7(2)12(4-5-13)10(14)9-6-15-8(3)11-9/h6-7,13H,4-5H2,1-3H3
InChIKeyKRORLTNBSAZXID-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.29
Rot. Bonds4

About N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide

N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide (PubChem CID 65199061) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide
PubChem CID65199061
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC NameN-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)N(CCO)C(C)C)cs1
InChIInChI=1S/C10H16N2O2S/c1-7(2)12(4-5-13)10(14)9-6-15-8(3)11-9/h6-7,13H,4-5H2,1-3H3
InChIKeyKRORLTNBSAZXID-UHFFFAOYSA-N
XLogP1.29
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide (CID 65199061) is N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide is Cc1nc(C(=O)N(CCO)C(C)C)cs1.
What is the InChIKey of N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide?
The InChIKey is KRORLTNBSAZXID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-7(2)12(4-5-13)10(14)9-6-15-8(3)11-9/h6-7,13H,4-5H2,1-3H3.
What are the key properties of N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide?
N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide has a molecular weight of 228.32 g/mol, XLogP of 1.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 65199061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).