4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide

C19H21N3O3 — CID 99249750

IUPAC4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1
InChIInChI=1S/C19H21N3O3/c1-25-16-8-9-20-17(13-16)18(23)21-15-7-5-6-14(12-15)19(24)22-10-3-2-4-11-22/h5-9,12-13H,2-4,10-11H2,1H3,(H,21,23)
InChIKeyKORSJVFSJJJAKC-UHFFFAOYSA-N
MW339.40 g/mol
LogP2.97
Rot. Bonds4

About 4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide

4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide (PubChem CID 99249750) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is 4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide
PubChem CID99249750
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC Name4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1
InChIInChI=1S/C19H21N3O3/c1-25-16-8-9-20-17(13-16)18(23)21-15-7-5-6-14(12-15)19(24)22-10-3-2-4-11-22/h5-9,12-13H,2-4,10-11H2,1H3,(H,21,23)
InChIKeyKORSJVFSJJJAKC-UHFFFAOYSA-N
XLogP2.97
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide?
The IUPAC name of 4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide (CID 99249750) is 4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide is COc1ccnc(C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1.
What is the InChIKey of 4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide?
The InChIKey is KORSJVFSJJJAKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-25-16-8-9-20-17(13-16)18(23)21-15-7-5-6-14(12-15)19(24)22-10-3-2-4-11-22/h5-9,12-13H,2-4,10-11H2,1H3,(H,21,23).
What are the key properties of 4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide?
4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 99249750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).