N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide

C16H19N3O2S — CID 171474987

IUPACN-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide
SMILESCOC1CCC(NC(=O)c2cccc(-c3cncs3)n2)CC1
InChIInChI=1S/C16H19N3O2S/c1-21-12-7-5-11(6-8-12)18-16(20)14-4-2-3-13(19-14)15-9-17-10-22-15/h2-4,9-12H,5-8H2,1H3,(H,18,20)
InChIKeyMXURUHSVZZDSHT-UHFFFAOYSA-N
MW317.41 g/mol
LogP2.89
Rot. Bonds4

About N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide

N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide (PubChem CID 171474987) has the molecular formula C16H19N3O2S and a molecular weight of 317.41 g/mol. Its IUPAC name is N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide
PubChem CID171474987
Molecular FormulaC16H19N3O2S
Molecular Weight317.41 g/mol
Exact Mass317.12
IUPAC NameN-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide
SMILESCOC1CCC(NC(=O)c2cccc(-c3cncs3)n2)CC1
InChIInChI=1S/C16H19N3O2S/c1-21-12-7-5-11(6-8-12)18-16(20)14-4-2-3-13(19-14)15-9-17-10-22-15/h2-4,9-12H,5-8H2,1H3,(H,18,20)
InChIKeyMXURUHSVZZDSHT-UHFFFAOYSA-N
XLogP2.89
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.41
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyrazine-2-carboxamide
CID 170774180
N-cyclohexyl-4-methyl-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide;methanol
CID 166481113
6-(4-carbamoylphenyl)-N-cyclopropylpyridine-2-carboxamide
CID 117087014
4-chloro-N-cyclohexyl-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide;2-methoxyethanol
CID 156885898
6-[4-(cyclopropylcarbamoyl)phenyl]-N-(3,4,5-trimethoxyphenyl)pyridine-2-carboxamide
CID 117080606
2-N-cycloheptyl-6-N-cyclopropylpyridine-2,6-dicarboxamide
CID 109093881
6-imidazol-1-yl-N-(3-methoxycyclopentyl)pyridine-2-carboxamide
CID 166481672
6-cyclopropyl-N-(thian-4-yl)-2-(1,3-thiazol-5-yl)pyrimidine-4-carboxamide
CID 175539439
N-cyclopropyl-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyridine-2-carboxamide
CID 143934489
2-N-cycloheptyl-6-N-cyclohexylpyridine-2,6-dicarboxamide
CID 109095319
6-N-cyclopropyl-2-N-(2-ethoxyphenyl)pyridine-2,6-dicarboxamide
CID 109093936
ethyl 4-[(6-chloropyridine-2-carbonyl)amino]cyclohexane-1-carboxylate
CID 62235259

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide?
The IUPAC name of N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide (CID 171474987) is N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide is COC1CCC(NC(=O)c2cccc(-c3cncs3)n2)CC1.
What is the InChIKey of N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide?
The InChIKey is MXURUHSVZZDSHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2S/c1-21-12-7-5-11(6-8-12)18-16(20)14-4-2-3-13(19-14)15-9-17-10-22-15/h2-4,9-12H,5-8H2,1H3,(H,18,20).
What are the key properties of N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide?
N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide has a molecular weight of 317.41 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxycyclohexyl)-6-(1,3-thiazol-5-yl)pyridine-2-carboxamide is sourced from PubChem (CID 171474987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).