N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide

C19H21N3O3 — CID 23738906

IUPACN-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide
SMILESCOc1ccc(C(=O)NC(=O)N2CCCCC2c2cccnc2)cc1
InChIInChI=1S/C19H21N3O3/c1-25-16-9-7-14(8-10-16)18(23)21-19(24)22-12-3-2-6-17(22)15-5-4-11-20-13-15/h4-5,7-11,13,17H,2-3,6,12H2,1H3,(H,21,23,24)
InChIKeyGDBDGUWXNZMNTH-UHFFFAOYSA-N
MW339.40 g/mol
LogP3.17
Rot. Bonds3

About N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide

N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide (PubChem CID 23738906) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide
PubChem CID23738906
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC NameN-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide
SMILESCOc1ccc(C(=O)NC(=O)N2CCCCC2c2cccnc2)cc1
InChIInChI=1S/C19H21N3O3/c1-25-16-9-7-14(8-10-16)18(23)21-19(24)22-12-3-2-6-17(22)15-5-4-11-20-13-15/h4-5,7-11,13,17H,2-3,6,12H2,1H3,(H,21,23,24)
InChIKeyGDBDGUWXNZMNTH-UHFFFAOYSA-N
XLogP3.17
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide?
The IUPAC name of N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide (CID 23738906) is N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide?
The canonical SMILES for N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide is COc1ccc(C(=O)NC(=O)N2CCCCC2c2cccnc2)cc1.
What is the InChIKey of N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide?
The InChIKey is GDBDGUWXNZMNTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-25-16-9-7-14(8-10-16)18(23)21-19(24)22-12-3-2-6-17(22)15-5-4-11-20-13-15/h4-5,7-11,13,17H,2-3,6,12H2,1H3,(H,21,23,24).
What are the key properties of N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide?
N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxybenzoyl)-2-pyridin-3-ylpiperidine-1-carboxamide is sourced from PubChem (CID 23738906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).