N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen

C10H18N2OS — CID 176998060

IUPACN,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen
SMILESCC(C)NC(=O)c1nc(C(C)C)cs1.[H][H]
InChIInChI=1S/C10H16N2OS.H2/c1-6(2)8-5-14-10(12-8)9(13)11-7(3)4;/h5-7H,1-4H3,(H,11,13);1H
InChIKeyNMTWDMFIJUDQIR-UHFFFAOYSA-N
MW214.33 g/mol
LogP2.65
Rot. Bonds3

About N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen

N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen (PubChem CID 176998060) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen.

Molecular Properties

Compound NameN,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen
PubChem CID176998060
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC NameN,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen
SMILESCC(C)NC(=O)c1nc(C(C)C)cs1.[H][H]
InChIInChI=1S/C10H16N2OS.H2/c1-6(2)8-5-14-10(12-8)9(13)11-7(3)4;/h5-7H,1-4H3,(H,11,13);1H
InChIKeyNMTWDMFIJUDQIR-UHFFFAOYSA-N
XLogP2.65
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen?
The IUPAC name of N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen (CID 176998060) is N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen.
What is the SMILES notation for N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen?
The canonical SMILES for N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen is CC(C)NC(=O)c1nc(C(C)C)cs1.[H][H].
What is the InChIKey of N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen?
The InChIKey is NMTWDMFIJUDQIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS.H2/c1-6(2)8-5-14-10(12-8)9(13)11-7(3)4;/h5-7H,1-4H3,(H,11,13);1H.
What are the key properties of N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen?
N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen has a molecular weight of 214.33 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-di(propan-2-yl)-1,3-thiazole-2-carboxamide;molecular hydrogen is sourced from PubChem (CID 176998060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).