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

C14H17N3O2S — CID 119340800

IUPACN-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide
SMILESO=C(NCc1csc(-c2ccco2)n1)C1CCNCC1
InChIInChI=1S/C14H17N3O2S/c18-13(10-3-5-15-6-4-10)16-8-11-9-20-14(17-11)12-2-1-7-19-12/h1-2,7,9-10,15H,3-6,8H2,(H,16,18)
InChIKeyUGJNCPCPYZTLDN-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.02
Rot. Bonds4

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

N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide (PubChem CID 119340800) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide
PubChem CID119340800
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC NameN-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide
SMILESO=C(NCc1csc(-c2ccco2)n1)C1CCNCC1
InChIInChI=1S/C14H17N3O2S/c18-13(10-3-5-15-6-4-10)16-8-11-9-20-14(17-11)12-2-1-7-19-12/h1-2,7,9-10,15H,3-6,8H2,(H,16,18)
InChIKeyUGJNCPCPYZTLDN-UHFFFAOYSA-N
XLogP2.02
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4,4-difluoro-N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]cyclohexane-1-carboxamide
CID 122156451
N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]-3-piperidin-4-ylbutanamide
CID 119813700
1-cyclopropyl-N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]methanamine
CID 115593190
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]acetamide
CID 119813696
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]acetamide;hydrochloride
CID 119813695
2-(furan-2-yl)-N-[(1-piperidin-4-yltriazol-4-yl)methyl]-1,3-thiazole-4-carboxamide
CID 166242880
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]piperidine-4-carboxamide
CID 119266960
2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetic acid
CID 7176378
3-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]-1-[(2-hydroxycyclopentyl)methyl]-1-methylurea
CID 109398881
N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]-2-methyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 166276297
N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclopentanecarboxamide
CID 121123450
4-butyl-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]cyclohexane-1-carboxamide
CID 30607957

Frequently Asked Questions

What is the IUPAC name of N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide?
The IUPAC name of N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide (CID 119340800) is N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide?
The canonical SMILES for N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide is O=C(NCc1csc(-c2ccco2)n1)C1CCNCC1.
What is the InChIKey of N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide?
The InChIKey is UGJNCPCPYZTLDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c18-13(10-3-5-15-6-4-10)16-8-11-9-20-14(17-11)12-2-1-7-19-12/h1-2,7,9-10,15H,3-6,8H2,(H,16,18).
What are the key properties of N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide?
N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide has a molecular weight of 291.38 g/mol, XLogP of 2.02, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxamide is sourced from PubChem (CID 119340800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).