2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole

C14H18N2OS — CID 134033819

IUPAC2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole
SMILESCC1CCN(Cc2csc(-c3ccco3)n2)CC1
InChIInChI=1S/C14H18N2OS/c1-11-4-6-16(7-5-11)9-12-10-18-14(15-12)13-3-2-8-17-13/h2-3,8,10-11H,4-7,9H2,1H3
InChIKeySIDJNTRACYEZNC-UHFFFAOYSA-N
MW262.38 g/mol
LogP3.63
Rot. Bonds3

About 2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole

2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole (PubChem CID 134033819) has the molecular formula C14H18N2OS and a molecular weight of 262.38 g/mol. Its IUPAC name is 2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole.

Molecular Properties

Compound Name2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole
PubChem CID134033819
Molecular FormulaC14H18N2OS
Molecular Weight262.38 g/mol
Exact Mass262.11
IUPAC Name2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole
SMILESCC1CCN(Cc2csc(-c3ccco3)n2)CC1
InChIInChI=1S/C14H18N2OS/c1-11-4-6-16(7-5-11)9-12-10-18-14(15-12)13-3-2-8-17-13/h2-3,8,10-11H,4-7,9H2,1H3
InChIKeySIDJNTRACYEZNC-UHFFFAOYSA-N
XLogP3.63
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(furan-2-yl)-4-[(4-methoxypiperidin-1-yl)methyl]-1,3-thiazole
CID 134033891
methyl 1-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidine-4-carboxylate
CID 60714594
(3R)-1-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]pyrrolidin-3-amine;dihydrochloride
CID 119904967
1-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]-3,3-dimethylpiperidin-4-amine
CID 120775782
3-[[4-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]methyl]-5-methyl-1,2-oxazole
CID 134033856
(3S)-1-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidin-3-ol
CID 32611074
2-[4-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]acetic acid
CID 43521719
1-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperidin-3-amine;dihydrochloride
CID 119909924
1-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]-2-methylpyrrolidine-3-carboxylic acid
CID 79371085
2-(furan-2-yl)-4-[(3-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,3-thiazole
CID 138001376
2-[4-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]butan-1-ol
CID 111489708
N-cyclopropyl-2-[4-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]propanamide
CID 51339316

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole?
The IUPAC name of 2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole (CID 134033819) is 2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole.
What is the SMILES notation for 2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole?
The canonical SMILES for 2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole is CC1CCN(Cc2csc(-c3ccco3)n2)CC1.
What is the InChIKey of 2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole?
The InChIKey is SIDJNTRACYEZNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS/c1-11-4-6-16(7-5-11)9-12-10-18-14(15-12)13-3-2-8-17-13/h2-3,8,10-11H,4-7,9H2,1H3.
What are the key properties of 2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole?
2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole has a molecular weight of 262.38 g/mol, XLogP of 3.63, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazole is sourced from PubChem (CID 134033819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).