N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide

C19H22FN3OS — CID 24988580

IUPACN-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide
SMILESO=C(C1CC1)N(Cc1csc(N2CCCCC2)n1)c1ccc(F)cc1
InChIInChI=1S/C19H22FN3OS/c20-15-6-8-17(9-7-15)23(18(24)14-4-5-14)12-16-13-25-19(21-16)22-10-2-1-3-11-22/h6-9,13-14H,1-5,10-12H2
InChIKeyOQAXHMVNQRVTSF-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.22
Rot. Bonds5

About N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide

N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide (PubChem CID 24988580) has the molecular formula C19H22FN3OS and a molecular weight of 359.47 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide
PubChem CID24988580
Molecular FormulaC19H22FN3OS
Molecular Weight359.47 g/mol
Exact Mass359.15
IUPAC NameN-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide
SMILESO=C(C1CC1)N(Cc1csc(N2CCCCC2)n1)c1ccc(F)cc1
InChIInChI=1S/C19H22FN3OS/c20-15-6-8-17(9-7-15)23(18(24)14-4-5-14)12-16-13-25-19(21-16)22-10-2-1-3-11-22/h6-9,13-14H,1-5,10-12H2
InChIKeyOQAXHMVNQRVTSF-UHFFFAOYSA-N
XLogP4.22
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide (CID 24988580) is N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide is O=C(C1CC1)N(Cc1csc(N2CCCCC2)n1)c1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide?
The InChIKey is OQAXHMVNQRVTSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3OS/c20-15-6-8-17(9-7-15)23(18(24)14-4-5-14)12-16-13-25-19(21-16)22-10-2-1-3-11-22/h6-9,13-14H,1-5,10-12H2.
What are the key properties of N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide?
N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide has a molecular weight of 359.47 g/mol, XLogP of 4.22, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 24988580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).