N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide

C15H17N3O3 — CID 86979608

IUPACN-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide
SMILESCOc1ccc(CNC(=O)CCn2ccccc2=O)cn1
InChIInChI=1S/C15H17N3O3/c1-21-14-6-5-12(11-17-14)10-16-13(19)7-9-18-8-3-2-4-15(18)20/h2-6,8,11H,7,9-10H2,1H3,(H,16,19)
InChIKeyWQUBTTMYVFCEGH-UHFFFAOYSA-N
MW287.32 g/mol
LogP0.96
Rot. Bonds6

About N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide

N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide (PubChem CID 86979608) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide.

Molecular Properties

Compound NameN-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide
PubChem CID86979608
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide
SMILESCOc1ccc(CNC(=O)CCn2ccccc2=O)cn1
InChIInChI=1S/C15H17N3O3/c1-21-14-6-5-12(11-17-14)10-16-13(19)7-9-18-8-3-2-4-15(18)20/h2-6,8,11H,7,9-10H2,1H3,(H,16,19)
InChIKeyWQUBTTMYVFCEGH-UHFFFAOYSA-N
XLogP0.96
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-fluorophenyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 86979441
N-[3-[(6-methoxy-3-pyridinyl)methylamino]-3-oxopropyl]benzamide
CID 16602215
N-[[2-(hydroxymethyl)phenyl]methyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 110908908
N-[(6-methoxy-3-pyridinyl)methyl]-3-(3-methyldiazirin-3-yl)propanamide
CID 172882152
6-amino-N-[(6-methoxy-3-pyridinyl)methyl]hexanamide
CID 61275158
3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide
CID 87018968
4-(4-methoxyphenoxy)-N-[(6-methoxy-3-pyridinyl)methyl]butanamide
CID 18139589
4-(5-chloroindol-1-yl)-N-[(6-methoxy-3-pyridinyl)methyl]butanamide
CID 91646463
N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 78863438
N-[(6-methoxy-3-pyridinyl)methyl]-3-piperidin-2-ylpropanamide
CID 62209908
N-(6-methoxy-3-pyridinyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 33281766
2-(2-fluorophenoxy)-N-[(6-methoxy-3-pyridinyl)methyl]acetamide
CID 51306226

Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide?
The IUPAC name of N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide (CID 86979608) is N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide.
What is the SMILES notation for N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide?
The canonical SMILES for N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide is COc1ccc(CNC(=O)CCn2ccccc2=O)cn1.
What is the InChIKey of N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide?
The InChIKey is WQUBTTMYVFCEGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-21-14-6-5-12(11-17-14)10-16-13(19)7-9-18-8-3-2-4-15(18)20/h2-6,8,11H,7,9-10H2,1H3,(H,16,19).
What are the key properties of N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide?
N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide has a molecular weight of 287.32 g/mol, XLogP of 0.96, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxy-3-pyridinyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide is sourced from PubChem (CID 86979608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).