2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide

C13H23N5O — CID 115290278

IUPAC2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide
SMILESCCN1CCC(NC(=O)C(N)c2cnn(C)c2)CC1
InChIInChI=1S/C13H23N5O/c1-3-18-6-4-11(5-7-18)16-13(19)12(14)10-8-15-17(2)9-10/h8-9,11-12H,3-7,14H2,1-2H3,(H,16,19)
InChIKeyYQVHQCIBANWENQ-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.02
Rot. Bonds4

About 2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide

2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide (PubChem CID 115290278) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide
PubChem CID115290278
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide
SMILESCCN1CCC(NC(=O)C(N)c2cnn(C)c2)CC1
InChIInChI=1S/C13H23N5O/c1-3-18-6-4-11(5-7-18)16-13(19)12(14)10-8-15-17(2)9-10/h8-9,11-12H,3-7,14H2,1-2H3,(H,16,19)
InChIKeyYQVHQCIBANWENQ-UHFFFAOYSA-N
XLogP0.02
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide?
The IUPAC name of 2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide (CID 115290278) is 2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide.
What is the SMILES notation for 2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide?
The canonical SMILES for 2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide is CCN1CCC(NC(=O)C(N)c2cnn(C)c2)CC1.
What is the InChIKey of 2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide?
The InChIKey is YQVHQCIBANWENQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-3-18-6-4-11(5-7-18)16-13(19)12(14)10-8-15-17(2)9-10/h8-9,11-12H,3-7,14H2,1-2H3,(H,16,19).
What are the key properties of 2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide?
2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide has a molecular weight of 265.36 g/mol, XLogP of 0.02, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide is sourced from PubChem (CID 115290278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).