N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide

C17H29N5O — CID 119074986

IUPACN-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide
SMILESO=C(Cn1nccc1C1CCCNC1)NCCN1CCCCC1
InChIInChI=1S/C17H29N5O/c23-17(19-9-12-21-10-2-1-3-11-21)14-22-16(6-8-20-22)15-5-4-7-18-13-15/h6,8,15,18H,1-5,7,9-14H2,(H,19,23)
InChIKeyYSRFYZSEBXXWRU-UHFFFAOYSA-N
MW319.45 g/mol
LogP0.95
Rot. Bonds6

About N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide

N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide (PubChem CID 119074986) has the molecular formula C17H29N5O and a molecular weight of 319.45 g/mol. Its IUPAC name is N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide
PubChem CID119074986
Molecular FormulaC17H29N5O
Molecular Weight319.45 g/mol
Exact Mass319.24
IUPAC NameN-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide
SMILESO=C(Cn1nccc1C1CCCNC1)NCCN1CCCCC1
InChIInChI=1S/C17H29N5O/c23-17(19-9-12-21-10-2-1-3-11-21)14-22-16(6-8-20-22)15-5-4-7-18-13-15/h6,8,15,18H,1-5,7,9-14H2,(H,19,23)
InChIKeyYSRFYZSEBXXWRU-UHFFFAOYSA-N
XLogP0.95
TPSA62.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.45
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide?
The IUPAC name of N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide (CID 119074986) is N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide.
What is the SMILES notation for N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide?
The canonical SMILES for N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide is O=C(Cn1nccc1C1CCCNC1)NCCN1CCCCC1.
What is the InChIKey of N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide?
The InChIKey is YSRFYZSEBXXWRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N5O/c23-17(19-9-12-21-10-2-1-3-11-21)14-22-16(6-8-20-22)15-5-4-7-18-13-15/h6,8,15,18H,1-5,7,9-14H2,(H,19,23).
What are the key properties of N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide?
N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide has a molecular weight of 319.45 g/mol, XLogP of 0.95, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-ylethyl)-2-(5-piperidin-3-ylpyrazol-1-yl)acetamide is sourced from PubChem (CID 119074986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).