N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide

C16H23N3O — CID 22038275

IUPACN-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide
SMILESCC(=O)NCc1ccc2c(c1)N(C1CCNCC1)CC2
InChIInChI=1S/C16H23N3O/c1-12(20)18-11-13-2-3-14-6-9-19(16(14)10-13)15-4-7-17-8-5-15/h2-3,10,15,17H,4-9,11H2,1H3,(H,18,20)
InChIKeyOIKGVKMWIJRDBJ-UHFFFAOYSA-N
MW273.38 g/mol
LogP1.44
Rot. Bonds3

About N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide

N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide (PubChem CID 22038275) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide
PubChem CID22038275
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC NameN-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide
SMILESCC(=O)NCc1ccc2c(c1)N(C1CCNCC1)CC2
InChIInChI=1S/C16H23N3O/c1-12(20)18-11-13-2-3-14-6-9-19(16(14)10-13)15-4-7-17-8-5-15/h2-3,10,15,17H,4-9,11H2,1H3,(H,18,20)
InChIKeyOIKGVKMWIJRDBJ-UHFFFAOYSA-N
XLogP1.44
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide?
The IUPAC name of N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide (CID 22038275) is N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide.
What is the SMILES notation for N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide?
The canonical SMILES for N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide is CC(=O)NCc1ccc2c(c1)N(C1CCNCC1)CC2.
What is the InChIKey of N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide?
The InChIKey is OIKGVKMWIJRDBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-12(20)18-11-13-2-3-14-6-9-19(16(14)10-13)15-4-7-17-8-5-15/h2-3,10,15,17H,4-9,11H2,1H3,(H,18,20).
What are the key properties of N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide?
N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide has a molecular weight of 273.38 g/mol, XLogP of 1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-piperidin-4-yl-2,3-dihydroindol-6-yl)methyl]acetamide is sourced from PubChem (CID 22038275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).