2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide

C15H23N5O2 — CID 72820761

IUPAC2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide
SMILESCCC(C)C(N)C(=O)N1CCCN1C(=O)Nc1ccncc1
InChIInChI=1S/C15H23N5O2/c1-3-11(2)13(16)14(21)19-9-4-10-20(19)15(22)18-12-5-7-17-8-6-12/h5-8,11,13H,3-4,9-10,16H2,1-2H3,(H,17,18,22)
InChIKeyGRFVAACGFPIWOC-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.44
Rot. Bonds4

About 2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide

2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide (PubChem CID 72820761) has the molecular formula C15H23N5O2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide.

Molecular Properties

Compound Name2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide
PubChem CID72820761
Molecular FormulaC15H23N5O2
Molecular Weight305.38 g/mol
Exact Mass305.19
IUPAC Name2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide
SMILESCCC(C)C(N)C(=O)N1CCCN1C(=O)Nc1ccncc1
InChIInChI=1S/C15H23N5O2/c1-3-11(2)13(16)14(21)19-9-4-10-20(19)15(22)18-12-5-7-17-8-6-12/h5-8,11,13H,3-4,9-10,16H2,1-2H3,(H,17,18,22)
InChIKeyGRFVAACGFPIWOC-UHFFFAOYSA-N
XLogP1.44
TPSA91.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide?
The IUPAC name of 2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide (CID 72820761) is 2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide.
What is the SMILES notation for 2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide?
The canonical SMILES for 2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide is CCC(C)C(N)C(=O)N1CCCN1C(=O)Nc1ccncc1.
What is the InChIKey of 2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide?
The InChIKey is GRFVAACGFPIWOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O2/c1-3-11(2)13(16)14(21)19-9-4-10-20(19)15(22)18-12-5-7-17-8-6-12/h5-8,11,13H,3-4,9-10,16H2,1-2H3,(H,17,18,22).
What are the key properties of 2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide?
2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-3-methylpentanoyl)-N-pyridin-4-ylpyrazolidine-1-carboxamide is sourced from PubChem (CID 72820761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).