2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide

C12H21N5O — CID 104619348

IUPAC2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
SMILESCCc1cn[nH]c1NC(=O)CN1CCC(N)CC1
InChIInChI=1S/C12H21N5O/c1-2-9-7-14-16-12(9)15-11(18)8-17-5-3-10(13)4-6-17/h7,10H,2-6,8,13H2,1H3,(H2,14,15,16,18)
InChIKeyYYGHPPHIZXGTPN-UHFFFAOYSA-N
MW251.33 g/mol
LogP0.33
Rot. Bonds4

About 2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide

2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide (PubChem CID 104619348) has the molecular formula C12H21N5O and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
PubChem CID104619348
Molecular FormulaC12H21N5O
Molecular Weight251.33 g/mol
Exact Mass251.17
IUPAC Name2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
SMILESCCc1cn[nH]c1NC(=O)CN1CCC(N)CC1
InChIInChI=1S/C12H21N5O/c1-2-9-7-14-16-12(9)15-11(18)8-17-5-3-10(13)4-6-17/h7,10H,2-6,8,13H2,1H3,(H2,14,15,16,18)
InChIKeyYYGHPPHIZXGTPN-UHFFFAOYSA-N
XLogP0.33
TPSA87.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 50.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide (CID 104619348) is 2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide is CCc1cn[nH]c1NC(=O)CN1CCC(N)CC1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
The InChIKey is YYGHPPHIZXGTPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O/c1-2-9-7-14-16-12(9)15-11(18)8-17-5-3-10(13)4-6-17/h7,10H,2-6,8,13H2,1H3,(H2,14,15,16,18).
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide has a molecular weight of 251.33 g/mol, XLogP of 0.33, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide is sourced from PubChem (CID 104619348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).