N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide

C15H23N3O — CID 176691997

IUPACN-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(C2CCN(C(C)C)CC2)cn1
InChIInChI=1S/C15H23N3O/c1-11(2)18-8-6-13(7-9-18)14-4-5-15(16-10-14)17-12(3)19/h4-5,10-11,13H,6-9H2,1-3H3,(H,16,17,19)
InChIKeyJJKQPFQZAHALOQ-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.63
Rot. Bonds3

About N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide

N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide (PubChem CID 176691997) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide
PubChem CID176691997
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(C2CCN(C(C)C)CC2)cn1
InChIInChI=1S/C15H23N3O/c1-11(2)18-8-6-13(7-9-18)14-4-5-15(16-10-14)17-12(3)19/h4-5,10-11,13H,6-9H2,1-3H3,(H,16,17,19)
InChIKeyJJKQPFQZAHALOQ-UHFFFAOYSA-N
XLogP2.63
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide?
The IUPAC name of N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide (CID 176691997) is N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide.
What is the SMILES notation for N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide?
The canonical SMILES for N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide is CC(=O)Nc1ccc(C2CCN(C(C)C)CC2)cn1.
What is the InChIKey of N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide?
The InChIKey is JJKQPFQZAHALOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(2)18-8-6-13(7-9-18)14-4-5-15(16-10-14)17-12(3)19/h4-5,10-11,13H,6-9H2,1-3H3,(H,16,17,19).
What are the key properties of N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide?
N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide has a molecular weight of 261.37 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]acetamide is sourced from PubChem (CID 176691997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).