1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide

C19H19FN4OS — CID 91952377

IUPAC1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide
SMILESO=C(NCc1nccs1)C1CCN(c2ccnc3ccc(F)cc23)CC1
InChIInChI=1S/C19H19FN4OS/c20-14-1-2-16-15(11-14)17(3-6-21-16)24-8-4-13(5-9-24)19(25)23-12-18-22-7-10-26-18/h1-3,6-7,10-11,13H,4-5,8-9,12H2,(H,23,25)
InChIKeyCWHSCZWVRSESSJ-UHFFFAOYSA-N
MW370.45 g/mol
LogP3.36
Rot. Bonds4

About 1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide

1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide (PubChem CID 91952377) has the molecular formula C19H19FN4OS and a molecular weight of 370.45 g/mol. Its IUPAC name is 1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide
PubChem CID91952377
Molecular FormulaC19H19FN4OS
Molecular Weight370.45 g/mol
Exact Mass370.13
IUPAC Name1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide
SMILESO=C(NCc1nccs1)C1CCN(c2ccnc3ccc(F)cc23)CC1
InChIInChI=1S/C19H19FN4OS/c20-14-1-2-16-15(11-14)17(3-6-21-16)24-8-4-13(5-9-24)19(25)23-12-18-22-7-10-26-18/h1-3,6-7,10-11,13H,4-5,8-9,12H2,(H,23,25)
InChIKeyCWHSCZWVRSESSJ-UHFFFAOYSA-N
XLogP3.36
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(6-methylquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-3-carboxamide
CID 91952178
N-[(4-fluorophenyl)methyl]-1-thieno[3,2-b]pyridin-7-ylpiperidine-4-carboxamide
CID 133318641
azepan-1-yl-[1-(6-fluoroquinolin-4-yl)piperidin-4-yl]methanone
CID 91952386
N-[3-(2-ethylimidazol-1-yl)propyl]-1-(6-fluoroquinolin-4-yl)piperidine-4-carboxamide
CID 91952370
1-(6-fluoroquinolin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide
CID 91952358
2-[1-(6-fluoroquinolin-4-yl)piperidin-4-yl]acetic acid
CID 121318145
N-[(4-fluorophenyl)methyl]-1-[6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]quinolin-4-yl]piperidine-4-carboxamide
CID 139997630
1-(6-fluoroquinolin-4-yl)-N-[3-(3-methylindazol-1-yl)propyl]piperidine-4-carboxamide
CID 91952366
1-(6-chloroquinolin-4-yl)-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
CID 133356365
N-[(3-fluoro-4-methylphenyl)methyl]-1-thieno[3,2-b]pyridin-7-ylpiperidine-4-carboxamide
CID 133317132
6-fluoro-4-piperidin-1-ylquinoline
CID 142561442
[1-(6-fluoroquinolin-4-yl)piperidin-4-yl] butanoate
CID 175115794

Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide (CID 91952377) is 1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide is O=C(NCc1nccs1)C1CCN(c2ccnc3ccc(F)cc23)CC1.
What is the InChIKey of 1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide?
The InChIKey is CWHSCZWVRSESSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4OS/c20-14-1-2-16-15(11-14)17(3-6-21-16)24-8-4-13(5-9-24)19(25)23-12-18-22-7-10-26-18/h1-3,6-7,10-11,13H,4-5,8-9,12H2,(H,23,25).
What are the key properties of 1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide?
1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide has a molecular weight of 370.45 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoroquinolin-4-yl)-N-(1,3-thiazol-2-ylmethyl)piperidine-4-carboxamide is sourced from PubChem (CID 91952377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).