N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide

C15H18N4OS — CID 119477790

IUPACN-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
SMILESNC1CCC(NC(=O)c2cnc(-c3ccccn3)s2)CC1
InChIInChI=1S/C15H18N4OS/c16-10-4-6-11(7-5-10)19-14(20)13-9-18-15(21-13)12-3-1-2-8-17-12/h1-3,8-11H,4-7,16H2,(H,19,20)
InChIKeyPZOCLDWXSIUXPQ-UHFFFAOYSA-N
MW302.40 g/mol
LogP2.20
Rot. Bonds3

About N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide

N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide (PubChem CID 119477790) has the molecular formula C15H18N4OS and a molecular weight of 302.40 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
PubChem CID119477790
Molecular FormulaC15H18N4OS
Molecular Weight302.40 g/mol
Exact Mass302.12
IUPAC NameN-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
SMILESNC1CCC(NC(=O)c2cnc(-c3ccccn3)s2)CC1
InChIInChI=1S/C15H18N4OS/c16-10-4-6-11(7-5-10)19-14(20)13-9-18-15(21-13)12-3-1-2-8-17-12/h1-3,8-11H,4-7,16H2,(H,19,20)
InChIKeyPZOCLDWXSIUXPQ-UHFFFAOYSA-N
XLogP2.20
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(8-azabicyclo[3.2.1]octan-3-yl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 119458360
N-piperidin-3-yl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119427844
[4-(methylamino)piperidin-1-yl]-(2-pyridin-2-yl-1,3-thiazol-5-yl)methanone;dihydrochloride
CID 119562862
N-(2-piperidin-3-ylethyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119558250
N-(4-aminocyclohexyl)-2-propyl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119479154
N-cyclopropyl-2-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 110647283
2-bromo-N-cyclopropyl-1,3-thiazole-5-carboxamide
CID 67019715
2-pyrimidin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide
CID 119449848
N-(4-aminocyclohexyl)pyridazine-4-carboxamide
CID 104670019
N-[2-(methylamino)propyl]-2-pyridin-2-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 120828248
N-[4-(pyridine-2-carbonylamino)cyclohexyl]pyridine-2-carboxamide
CID 167956409
N-(4-aminocyclohexyl)-3-fluoropyridine-4-carboxamide
CID 64950869

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide (CID 119477790) is N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide is NC1CCC(NC(=O)c2cnc(-c3ccccn3)s2)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide?
The InChIKey is PZOCLDWXSIUXPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4OS/c16-10-4-6-11(7-5-10)19-14(20)13-9-18-15(21-13)12-3-1-2-8-17-12/h1-3,8-11H,4-7,16H2,(H,19,20).
What are the key properties of N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide?
N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide has a molecular weight of 302.40 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 119477790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).