N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide

C21H25N3O3 — CID 55686867

IUPACN-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide
SMILESCC(C)Oc1ccc(C(=O)Nc2ccccc2C(=O)N2CCCCC2)cn1
InChIInChI=1S/C21H25N3O3/c1-15(2)27-19-11-10-16(14-22-19)20(25)23-18-9-5-4-8-17(18)21(26)24-12-6-3-7-13-24/h4-5,8-11,14-15H,3,6-7,12-13H2,1-2H3,(H,23,25)
InChIKeyCKMIEZFMMWUYSR-UHFFFAOYSA-N
MW367.45 g/mol
LogP3.75
Rot. Bonds5

About N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide

N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide (PubChem CID 55686867) has the molecular formula C21H25N3O3 and a molecular weight of 367.45 g/mol. Its IUPAC name is N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide
PubChem CID55686867
Molecular FormulaC21H25N3O3
Molecular Weight367.45 g/mol
Exact Mass367.19
IUPAC NameN-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide
SMILESCC(C)Oc1ccc(C(=O)Nc2ccccc2C(=O)N2CCCCC2)cn1
InChIInChI=1S/C21H25N3O3/c1-15(2)27-19-11-10-16(14-22-19)20(25)23-18-9-5-4-8-17(18)21(26)24-12-6-3-7-13-24/h4-5,8-11,14-15H,3,6-7,12-13H2,1-2H3,(H,23,25)
InChIKeyCKMIEZFMMWUYSR-UHFFFAOYSA-N
XLogP3.75
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide?
The IUPAC name of N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide (CID 55686867) is N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide.
What is the SMILES notation for N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide?
The canonical SMILES for N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide is CC(C)Oc1ccc(C(=O)Nc2ccccc2C(=O)N2CCCCC2)cn1.
What is the InChIKey of N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide?
The InChIKey is CKMIEZFMMWUYSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O3/c1-15(2)27-19-11-10-16(14-22-19)20(25)23-18-9-5-4-8-17(18)21(26)24-12-6-3-7-13-24/h4-5,8-11,14-15H,3,6-7,12-13H2,1-2H3,(H,23,25).
What are the key properties of N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide?
N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide has a molecular weight of 367.45 g/mol, XLogP of 3.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(piperidine-1-carbonyl)phenyl]-6-propan-2-yloxypyridine-3-carboxamide is sourced from PubChem (CID 55686867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).