N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide

C18H23N5O2 — CID 167786103

IUPACN-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide
SMILESCc1cc(C#N)cc(NC(=O)C2CCN(C(=O)N3CCCC3)CC2)n1
InChIInChI=1S/C18H23N5O2/c1-13-10-14(12-19)11-16(20-13)21-17(24)15-4-8-23(9-5-15)18(25)22-6-2-3-7-22/h10-11,15H,2-9H2,1H3,(H,20,21,24)
InChIKeyDALOIJQDTGUZRP-UHFFFAOYSA-N
MW341.42 g/mol
LogP2.13
Rot. Bonds2

About N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide

N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide (PubChem CID 167786103) has the molecular formula C18H23N5O2 and a molecular weight of 341.42 g/mol. Its IUPAC name is N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide
PubChem CID167786103
Molecular FormulaC18H23N5O2
Molecular Weight341.42 g/mol
Exact Mass341.19
IUPAC NameN-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide
SMILESCc1cc(C#N)cc(NC(=O)C2CCN(C(=O)N3CCCC3)CC2)n1
InChIInChI=1S/C18H23N5O2/c1-13-10-14(12-19)11-16(20-13)21-17(24)15-4-8-23(9-5-15)18(25)22-6-2-3-7-22/h10-11,15H,2-9H2,1H3,(H,20,21,24)
InChIKeyDALOIJQDTGUZRP-UHFFFAOYSA-N
XLogP2.13
TPSA89.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-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 N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide (CID 167786103) is N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide is Cc1cc(C#N)cc(NC(=O)C2CCN(C(=O)N3CCCC3)CC2)n1.
What is the InChIKey of N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide?
The InChIKey is DALOIJQDTGUZRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O2/c1-13-10-14(12-19)11-16(20-13)21-17(24)15-4-8-23(9-5-15)18(25)22-6-2-3-7-22/h10-11,15H,2-9H2,1H3,(H,20,21,24).
What are the key properties of N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide?
N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide has a molecular weight of 341.42 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyano-6-methyl-2-pyridinyl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 167786103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).