(2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone

C16H20N2O2S — CID 110383835

IUPAC(2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone
SMILESCCC1CCCCN1C(=O)c1ccc(-c2csc(C)n2)o1
InChIInChI=1S/C16H20N2O2S/c1-3-12-6-4-5-9-18(12)16(19)15-8-7-14(20-15)13-10-21-11(2)17-13/h7-8,10,12H,3-6,9H2,1-2H3
InChIKeyDGCQSUBHRLWEEJ-UHFFFAOYSA-N
MW304.42 g/mol
LogP4.12
Rot. Bonds3

About (2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone

(2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone (PubChem CID 110383835) has the molecular formula C16H20N2O2S and a molecular weight of 304.42 g/mol. Its IUPAC name is (2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone.

Molecular Properties

Compound Name(2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone
PubChem CID110383835
Molecular FormulaC16H20N2O2S
Molecular Weight304.42 g/mol
Exact Mass304.12
IUPAC Name(2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone
SMILESCCC1CCCCN1C(=O)c1ccc(-c2csc(C)n2)o1
InChIInChI=1S/C16H20N2O2S/c1-3-12-6-4-5-9-18(12)16(19)15-8-7-14(20-15)13-10-21-11(2)17-13/h7-8,10,12H,3-6,9H2,1-2H3
InChIKeyDGCQSUBHRLWEEJ-UHFFFAOYSA-N
XLogP4.12
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5-aminofuran-2-yl)-(2-ethylpiperidin-1-yl)methanone
CID 82344192
(5-bromofuran-2-yl)-(2-ethylazepan-1-yl)methanone
CID 115642379
N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
CID 110383761
(2-ethylpiperidin-1-yl)-(7-methylfuro[2,3-b]quinolin-2-yl)methanone
CID 5044106
[4-[(2S)-2-ethylpiperidine-1-carbonyl]phenyl]-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 1087323
[2-(2-hydroxypropyl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone
CID 79539295
[6-[(2S)-2-ethylpiperidine-1-carbonyl]-2-pyridinyl]-[(2S)-2-ethylpiperidin-1-yl]methanone
CID 40585097
[2-(2-hydroxypropyl)azepan-1-yl]-(5-methylfuran-2-yl)methanone
CID 79560605
[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-[1-methyl-4-(2-methyl-1,3-thiazol-4-yl)pyrrol-2-yl]methanone
CID 79027845
[2-[(4-methoxyphenyl)methyl]pyrrolidin-1-yl]-(2-methyl-1,3-thiazol-4-yl)methanone
CID 56820329
[2-(aminomethyl)azepan-1-yl]-(5-methylfuran-2-yl)methanone
CID 116639926
[2-(aminomethyl)piperidin-1-yl]-(5-methylfuran-2-yl)methanone;hydrochloride
CID 119468513

Frequently Asked Questions

What is the IUPAC name of (2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone?
The IUPAC name of (2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone (CID 110383835) is (2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone.
What is the SMILES notation for (2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone?
The canonical SMILES for (2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone is CCC1CCCCN1C(=O)c1ccc(-c2csc(C)n2)o1.
What is the InChIKey of (2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone?
The InChIKey is DGCQSUBHRLWEEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S/c1-3-12-6-4-5-9-18(12)16(19)15-8-7-14(20-15)13-10-21-11(2)17-13/h7-8,10,12H,3-6,9H2,1-2H3.
What are the key properties of (2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone?
(2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone has a molecular weight of 304.42 g/mol, XLogP of 4.12, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpiperidin-1-yl)-[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methanone is sourced from PubChem (CID 110383835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).