N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide

C16H25N3OS — CID 23765843

IUPACN-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide
SMILESCN(C(=O)c1csc(C2CCNCC2)n1)C1CCCCC1
InChIInChI=1S/C16H25N3OS/c1-19(13-5-3-2-4-6-13)16(20)14-11-21-15(18-14)12-7-9-17-10-8-12/h11-13,17H,2-10H2,1H3
InChIKeyQKHQPMMKAFBZGG-UHFFFAOYSA-N
MW307.46 g/mol
LogP3.01
Rot. Bonds3

About N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide

N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide (PubChem CID 23765843) has the molecular formula C16H25N3OS and a molecular weight of 307.46 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide
PubChem CID23765843
Molecular FormulaC16H25N3OS
Molecular Weight307.46 g/mol
Exact Mass307.17
IUPAC NameN-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide
SMILESCN(C(=O)c1csc(C2CCNCC2)n1)C1CCCCC1
InChIInChI=1S/C16H25N3OS/c1-19(13-5-3-2-4-6-13)16(20)14-11-21-15(18-14)12-7-9-17-10-8-12/h11-13,17H,2-10H2,1H3
InChIKeyQKHQPMMKAFBZGG-UHFFFAOYSA-N
XLogP3.01
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.46
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-aminoethyl)-N-cycloheptyl-N-methyl-1,3-thiazole-4-carboxamide
CID 66390398
2-piperidin-4-yl-1,3-thiazole-4-carboxamide
CID 66679882
N-cyclohexyl-N-methyl-2-[1-(4-propan-2-yloxybenzoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide
CID 23799785
N-cyclohexyl-N-methyl-2-phenyl-1,3-thiazole-4-carboxamide
CID 46823386
2-(aminomethyl)-N-cyclobutyl-N-methyl-1,3-thiazole-4-carboxamide
CID 115739589
(2-methylpiperidin-1-yl)-(2-piperidin-4-yl-1,3-thiazol-4-yl)methanone
CID 3875834
N-methyl-N-piperidin-4-yl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119444395
fluoro 2-piperidin-4-yl-1,3-thiazole-4-carboxylate
CID 156738991
N-methyl-2-propan-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
CID 119552868
tert-butyl 4-[4-[methyl-(1-methylpiperidin-4-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate
CID 23963991
N-methyl-2-(5-methylfuran-2-yl)-N-piperidin-4-yl-1,3-thiazole-4-carboxamide;hydrochloride
CID 119444482
N-cyclooctyl-N-methyl-1-piperidin-4-yltriazole-4-carboxamide
CID 119763852

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide (CID 23765843) is N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide is CN(C(=O)c1csc(C2CCNCC2)n1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide?
The InChIKey is QKHQPMMKAFBZGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3OS/c1-19(13-5-3-2-4-6-13)16(20)14-11-21-15(18-14)12-7-9-17-10-8-12/h11-13,17H,2-10H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide?
N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide has a molecular weight of 307.46 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 23765843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).