N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide

C11H17N3OS — CID 61044449

IUPACN-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide
SMILESCc1csc(CNC(=O)C2CCNCC2)n1
InChIInChI=1S/C11H17N3OS/c1-8-7-16-10(14-8)6-13-11(15)9-2-4-12-5-3-9/h7,9,12H,2-6H2,1H3,(H,13,15)
InChIKeySPHLXIMEZVJADS-UHFFFAOYSA-N
MW239.34 g/mol
LogP1.07
Rot. Bonds3

About N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide

N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide (PubChem CID 61044449) has the molecular formula C11H17N3OS and a molecular weight of 239.34 g/mol. Its IUPAC name is N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide
PubChem CID61044449
Molecular FormulaC11H17N3OS
Molecular Weight239.34 g/mol
Exact Mass239.11
IUPAC NameN-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide
SMILESCc1csc(CNC(=O)C2CCNCC2)n1
InChIInChI=1S/C11H17N3OS/c1-8-7-16-10(14-8)6-13-11(15)9-2-4-12-5-3-9/h7,9,12H,2-6H2,1H3,(H,13,15)
InChIKeySPHLXIMEZVJADS-UHFFFAOYSA-N
XLogP1.07
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide;dihydrochloride
CID 119839235
3-amino-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclopentane-1-carboxamide
CID 66008151
1-methylsulfonyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide
CID 51323360
N-[2-[(4-methyl-1,3-thiazol-2-yl)methylamino]ethyl]cyclopropanecarboxamide
CID 115633613
1-cyclohexyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide
CID 72844101
(2R)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-2-carboxamide;dihydrochloride
CID 119839231
(2R)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 94177447
N-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119897431
N-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119878911
4-ethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-2-carboxamide
CID 114428592
N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]pyrrolidine-3-carboxamide
CID 119793176
N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1-piperidin-4-yltriazole-4-carboxamide;dihydrochloride
CID 119839239

Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide?
The IUPAC name of N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide (CID 61044449) is N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide?
The canonical SMILES for N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide is Cc1csc(CNC(=O)C2CCNCC2)n1.
What is the InChIKey of N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide?
The InChIKey is SPHLXIMEZVJADS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3OS/c1-8-7-16-10(14-8)6-13-11(15)9-2-4-12-5-3-9/h7,9,12H,2-6H2,1H3,(H,13,15).
What are the key properties of N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide?
N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide has a molecular weight of 239.34 g/mol, XLogP of 1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 61044449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).