N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide

C13H20N4O2 — CID 75369149

IUPACN-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1C(=O)Cc1cnn(C)c1
InChIInChI=1S/C13H20N4O2/c1-14-13(19)11-5-3-4-6-17(11)12(18)7-10-8-15-16(2)9-10/h8-9,11H,3-7H2,1-2H3,(H,14,19)
InChIKeySREFUQWZKDELMH-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.09
Rot. Bonds3

About N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide

N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide (PubChem CID 75369149) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide
PubChem CID75369149
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1C(=O)Cc1cnn(C)c1
InChIInChI=1S/C13H20N4O2/c1-14-13(19)11-5-3-4-6-17(11)12(18)7-10-8-15-16(2)9-10/h8-9,11H,3-7H2,1-2H3,(H,14,19)
InChIKeySREFUQWZKDELMH-UHFFFAOYSA-N
XLogP0.09
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide?
The IUPAC name of N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide (CID 75369149) is N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide.
What is the SMILES notation for N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide?
The canonical SMILES for N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide is CNC(=O)C1CCCCN1C(=O)Cc1cnn(C)c1.
What is the InChIKey of N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide?
The InChIKey is SREFUQWZKDELMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-14-13(19)11-5-3-4-6-17(11)12(18)7-10-8-15-16(2)9-10/h8-9,11H,3-7H2,1-2H3,(H,14,19).
What are the key properties of N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide?
N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide is sourced from PubChem (CID 75369149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).