N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide

C16H20N4OS — CID 120601114

IUPACN-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide
SMILESCC1CC(NC(=O)Cc2csc(-c3cccnc3)n2)CCN1
InChIInChI=1S/C16H20N4OS/c1-11-7-13(4-6-18-11)19-15(21)8-14-10-22-16(20-14)12-3-2-5-17-9-12/h2-3,5,9-11,13,18H,4,6-8H2,1H3,(H,19,21)
InChIKeyVEMAMYIXWWDCAX-UHFFFAOYSA-N
MW316.43 g/mol
LogP2.00
Rot. Bonds4

About N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide

N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide (PubChem CID 120601114) has the molecular formula C16H20N4OS and a molecular weight of 316.43 g/mol. Its IUPAC name is N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide
PubChem CID120601114
Molecular FormulaC16H20N4OS
Molecular Weight316.43 g/mol
Exact Mass316.14
IUPAC NameN-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide
SMILESCC1CC(NC(=O)Cc2csc(-c3cccnc3)n2)CCN1
InChIInChI=1S/C16H20N4OS/c1-11-7-13(4-6-18-11)19-15(21)8-14-10-22-16(20-14)12-3-2-5-17-9-12/h2-3,5,9-11,13,18H,4,6-8H2,1H3,(H,19,21)
InChIKeyVEMAMYIXWWDCAX-UHFFFAOYSA-N
XLogP2.00
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.43
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methylpiperidin-4-yl)-2-[2-[3-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]acetamide;dihydrochloride
CID 120599425
2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-methylpiperidin-4-yl)acetamide
CID 120601835
2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-methylpiperidin-4-yl)acetamide;dihydrochloride
CID 120601834
N-[(3S)-1-cyclopropylpyrrolidin-3-yl]-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide
CID 94694926
N-[(3R)-1-cyclopropylpyrrolidin-3-yl]-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide
CID 94694925
2-(2-ethyl-1,3-thiazol-4-yl)-N-(2-methylpiperidin-4-yl)acetamide;dihydrochloride
CID 120602063
2-(2-pyridin-3-yl-1,3-thiazol-4-yl)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95142510
N-[2-(methylamino)ethyl]-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide
CID 119502386
N-(2-acetamidoethyl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide
CID 39084427
N-(pyridin-3-ylmethyl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide
CID 39084438
N-cyclopropyl-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetamide
CID 17438306
N-[[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]methyl]-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide
CID 98753808

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide (CID 120601114) is N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide is CC1CC(NC(=O)Cc2csc(-c3cccnc3)n2)CCN1.
What is the InChIKey of N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide?
The InChIKey is VEMAMYIXWWDCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4OS/c1-11-7-13(4-6-18-11)19-15(21)8-14-10-22-16(20-14)12-3-2-5-17-9-12/h2-3,5,9-11,13,18H,4,6-8H2,1H3,(H,19,21).
What are the key properties of N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide?
N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide has a molecular weight of 316.43 g/mol, XLogP of 2.00, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-4-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 120601114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).