N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide

C19H24FN3O2 — CID 171994846

IUPACN-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide
SMILESO=C(CC1CCN(c2nc3ccc(F)cc3o2)CC1)NC1CCCC1
InChIInChI=1S/C19H24FN3O2/c20-14-5-6-16-17(12-14)25-19(22-16)23-9-7-13(8-10-23)11-18(24)21-15-3-1-2-4-15/h5-6,12-13,15H,1-4,7-11H2,(H,21,24)
InChIKeyOUZSTEXYVHSLKN-UHFFFAOYSA-N
MW345.42 g/mol
LogP3.63
Rot. Bonds4

About N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide

N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide (PubChem CID 171994846) has the molecular formula C19H24FN3O2 and a molecular weight of 345.42 g/mol. Its IUPAC name is N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide
PubChem CID171994846
Molecular FormulaC19H24FN3O2
Molecular Weight345.42 g/mol
Exact Mass345.19
IUPAC NameN-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide
SMILESO=C(CC1CCN(c2nc3ccc(F)cc3o2)CC1)NC1CCCC1
InChIInChI=1S/C19H24FN3O2/c20-14-5-6-16-17(12-14)25-19(22-16)23-9-7-13(8-10-23)11-18(24)21-15-3-1-2-4-15/h5-6,12-13,15H,1-4,7-11H2,(H,21,24)
InChIKeyOUZSTEXYVHSLKN-UHFFFAOYSA-N
XLogP3.63
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.42
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide?
The IUPAC name of N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide (CID 171994846) is N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide is O=C(CC1CCN(c2nc3ccc(F)cc3o2)CC1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide?
The InChIKey is OUZSTEXYVHSLKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN3O2/c20-14-5-6-16-17(12-14)25-19(22-16)23-9-7-13(8-10-23)11-18(24)21-15-3-1-2-4-15/h5-6,12-13,15H,1-4,7-11H2,(H,21,24).
What are the key properties of N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide?
N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide has a molecular weight of 345.42 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[1-(6-fluoro-1,3-benzoxazol-2-yl)piperidin-4-yl]acetamide is sourced from PubChem (CID 171994846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).