(2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide

C16H21N5O — CID 94031024

IUPAC(2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide
SMILESC[C@H](Cn1cccn1)NC(=O)N1CCC[C@@H]1c1ccncc1
InChIInChI=1S/C16H21N5O/c1-13(12-20-10-3-7-18-20)19-16(22)21-11-2-4-15(21)14-5-8-17-9-6-14/h3,5-10,13,15H,2,4,11-12H2,1H3,(H,19,22)/t13-,15-/m1/s1
InChIKeyNAKACRRIQPJUES-UKRRQHHQSA-N
MW299.38 g/mol
LogP2.21
Rot. Bonds4

About (2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide

(2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide (PubChem CID 94031024) has the molecular formula C16H21N5O and a molecular weight of 299.38 g/mol. Its IUPAC name is (2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide
PubChem CID94031024
Molecular FormulaC16H21N5O
Molecular Weight299.38 g/mol
Exact Mass299.17
IUPAC Name(2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide
SMILESC[C@H](Cn1cccn1)NC(=O)N1CCC[C@@H]1c1ccncc1
InChIInChI=1S/C16H21N5O/c1-13(12-20-10-3-7-18-20)19-16(22)21-11-2-4-15(21)14-5-8-17-9-6-14/h3,5-10,13,15H,2,4,11-12H2,1H3,(H,19,22)/t13-,15-/m1/s1
InChIKeyNAKACRRIQPJUES-UKRRQHHQSA-N
XLogP2.21
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-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 (2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide?
The IUPAC name of (2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide (CID 94031024) is (2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide.
What is the SMILES notation for (2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide?
The canonical SMILES for (2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide is C[C@H](Cn1cccn1)NC(=O)N1CCC[C@@H]1c1ccncc1.
What is the InChIKey of (2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide?
The InChIKey is NAKACRRIQPJUES-UKRRQHHQSA-N. The full InChI is InChI=1S/C16H21N5O/c1-13(12-20-10-3-7-18-20)19-16(22)21-11-2-4-15(21)14-5-8-17-9-6-14/h3,5-10,13,15H,2,4,11-12H2,1H3,(H,19,22)/t13-,15-/m1/s1.
What are the key properties of (2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide?
(2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide has a molecular weight of 299.38 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide is sourced from PubChem (CID 94031024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).