1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide

C15H25N5O2 — CID 70710236

IUPAC1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide
SMILESCN(CCCn1cccn1)C(=O)C1CCN(CC(N)=O)CC1
InChIInChI=1S/C15H25N5O2/c1-18(7-3-9-20-8-2-6-17-20)15(22)13-4-10-19(11-5-13)12-14(16)21/h2,6,8,13H,3-5,7,9-12H2,1H3,(H2,16,21)
InChIKeyZRIWBEKNBYOWAJ-UHFFFAOYSA-N
MW307.40 g/mol
LogP-0.07
Rot. Bonds7

About 1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide

1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide (PubChem CID 70710236) has the molecular formula C15H25N5O2 and a molecular weight of 307.40 g/mol. Its IUPAC name is 1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide
PubChem CID70710236
Molecular FormulaC15H25N5O2
Molecular Weight307.40 g/mol
Exact Mass307.20
IUPAC Name1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide
SMILESCN(CCCn1cccn1)C(=O)C1CCN(CC(N)=O)CC1
InChIInChI=1S/C15H25N5O2/c1-18(7-3-9-20-8-2-6-17-20)15(22)13-4-10-19(11-5-13)12-14(16)21/h2,6,8,13H,3-5,7,9-12H2,1H3,(H2,16,21)
InChIKeyZRIWBEKNBYOWAJ-UHFFFAOYSA-N
XLogP-0.07
TPSA84.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide (CID 70710236) is 1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide is CN(CCCn1cccn1)C(=O)C1CCN(CC(N)=O)CC1.
What is the InChIKey of 1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide?
The InChIKey is ZRIWBEKNBYOWAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O2/c1-18(7-3-9-20-8-2-6-17-20)15(22)13-4-10-19(11-5-13)12-14(16)21/h2,6,8,13H,3-5,7,9-12H2,1H3,(H2,16,21).
What are the key properties of 1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide?
1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide has a molecular weight of 307.40 g/mol, XLogP of -0.07, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-oxoethyl)-N-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide is sourced from PubChem (CID 70710236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).