N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide

C19H23N3O3 — CID 75462276

IUPACN-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide
SMILESCn1cc(NC(=O)N2CCC(OCc3ccccc3)CC2)ccc1=O
InChIInChI=1S/C19H23N3O3/c1-21-13-16(7-8-18(21)23)20-19(24)22-11-9-17(10-12-22)25-14-15-5-3-2-4-6-15/h2-8,13,17H,9-12,14H2,1H3,(H,20,24)
InChIKeyBYXLCARLOGYKPB-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.60
Rot. Bonds4

About N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide

N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide (PubChem CID 75462276) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide
PubChem CID75462276
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide
SMILESCn1cc(NC(=O)N2CCC(OCc3ccccc3)CC2)ccc1=O
InChIInChI=1S/C19H23N3O3/c1-21-13-16(7-8-18(21)23)20-19(24)22-11-9-17(10-12-22)25-14-15-5-3-2-4-6-15/h2-8,13,17H,9-12,14H2,1H3,(H,20,24)
InChIKeyBYXLCARLOGYKPB-UHFFFAOYSA-N
XLogP2.60
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-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 N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide?
The IUPAC name of N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide (CID 75462276) is N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide.
What is the SMILES notation for N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide?
The canonical SMILES for N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide is Cn1cc(NC(=O)N2CCC(OCc3ccccc3)CC2)ccc1=O.
What is the InChIKey of N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide?
The InChIKey is BYXLCARLOGYKPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-21-13-16(7-8-18(21)23)20-19(24)22-11-9-17(10-12-22)25-14-15-5-3-2-4-6-15/h2-8,13,17H,9-12,14H2,1H3,(H,20,24).
What are the key properties of N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide?
N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide is sourced from PubChem (CID 75462276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).