N-cyclohexyl-1,3-thiazole-4-carboxamide

C10H14N2OS — CID 62045802

IUPACN-cyclohexyl-1,3-thiazole-4-carboxamide
SMILESO=C(NC1CCCCC1)c1cscn1
InChIInChI=1S/C10H14N2OS/c13-10(9-6-14-7-11-9)12-8-4-2-1-3-5-8/h6-8H,1-5H2,(H,12,13)
InChIKeyOVKIHOFCHGDJQM-UHFFFAOYSA-N
MW210.30 g/mol
LogP2.21
Rot. Bonds2

About N-cyclohexyl-1,3-thiazole-4-carboxamide

N-cyclohexyl-1,3-thiazole-4-carboxamide (PubChem CID 62045802) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is N-cyclohexyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1,3-thiazole-4-carboxamide
PubChem CID62045802
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC NameN-cyclohexyl-1,3-thiazole-4-carboxamide
SMILESO=C(NC1CCCCC1)c1cscn1
InChIInChI=1S/C10H14N2OS/c13-10(9-6-14-7-11-9)12-8-4-2-1-3-5-8/h6-8H,1-5H2,(H,12,13)
InChIKeyOVKIHOFCHGDJQM-UHFFFAOYSA-N
XLogP2.21
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-cyclohexyl-1,3-thiazole-4-carboxamide (CID 62045802) is N-cyclohexyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-cyclohexyl-1,3-thiazole-4-carboxamide is O=C(NC1CCCCC1)c1cscn1.
What is the InChIKey of N-cyclohexyl-1,3-thiazole-4-carboxamide?
The InChIKey is OVKIHOFCHGDJQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c13-10(9-6-14-7-11-9)12-8-4-2-1-3-5-8/h6-8H,1-5H2,(H,12,13).
What are the key properties of N-cyclohexyl-1,3-thiazole-4-carboxamide?
N-cyclohexyl-1,3-thiazole-4-carboxamide has a molecular weight of 210.30 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 62045802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).