N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide

C15H23N3O2 — CID 70289284

IUPACN-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide
SMILESCC(=O)NCCC1CCN(C(=O)C2CC=CC=N2)CC1
InChIInChI=1S/C15H23N3O2/c1-12(19)16-9-5-13-6-10-18(11-7-13)15(20)14-4-2-3-8-17-14/h2-3,8,13-14H,4-7,9-11H2,1H3,(H,16,19)
InChIKeyNTWAAUXBPBZUCJ-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.15
Rot. Bonds4

About N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide

N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide (PubChem CID 70289284) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide
PubChem CID70289284
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide
SMILESCC(=O)NCCC1CCN(C(=O)C2CC=CC=N2)CC1
InChIInChI=1S/C15H23N3O2/c1-12(19)16-9-5-13-6-10-18(11-7-13)15(20)14-4-2-3-8-17-14/h2-3,8,13-14H,4-7,9-11H2,1H3,(H,16,19)
InChIKeyNTWAAUXBPBZUCJ-UHFFFAOYSA-N
XLogP1.15
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide?
The IUPAC name of N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide (CID 70289284) is N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide is CC(=O)NCCC1CCN(C(=O)C2CC=CC=N2)CC1.
What is the InChIKey of N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide?
The InChIKey is NTWAAUXBPBZUCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-12(19)16-9-5-13-6-10-18(11-7-13)15(20)14-4-2-3-8-17-14/h2-3,8,13-14H,4-7,9-11H2,1H3,(H,16,19).
What are the key properties of N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide?
N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(2,3-dihydropyridine-2-carbonyl)piperidin-4-yl]ethyl]acetamide is sourced from PubChem (CID 70289284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).