N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide

C12H11N3O2 — CID 121016050

IUPACN-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide
SMILESCC(=O)Nc1ccc2c(C)cc(C=O)nc2n1
InChIInChI=1S/C12H11N3O2/c1-7-5-9(6-16)14-12-10(7)3-4-11(15-12)13-8(2)17/h3-6H,1-2H3,(H,13,14,15,17)
InChIKeyDFSPGJHBECPJJX-UHFFFAOYSA-N
MW229.24 g/mol
LogP1.71
Rot. Bonds2

About N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide

N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide (PubChem CID 121016050) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide.

Molecular Properties

Compound NameN-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide
PubChem CID121016050
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC NameN-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide
SMILESCC(=O)Nc1ccc2c(C)cc(C=O)nc2n1
InChIInChI=1S/C12H11N3O2/c1-7-5-9(6-16)14-12-10(7)3-4-11(15-12)13-8(2)17/h3-6H,1-2H3,(H,13,14,15,17)
InChIKeyDFSPGJHBECPJJX-UHFFFAOYSA-N
XLogP1.71
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-(5,7-dimethyl-1,8-naphthyridin-2-yl)butanamide
CID 6488581
N-(5-methyl-7-oxo-8H-1,8-naphthyridin-2-yl)acetamide
CID 14751715
N-[7-(4-carbamimidoylphenoxy)-5-methyl-1,8-naphthyridin-2-yl]acetamide
CID 21250335
2-(5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiin-2-ylidene)-N-(5,7-dimethyl-1,8-naphthyridin-2-yl)-1,3-dithiole-4-carboxamide
CID 102485370
N-(5,7-dimethyl-1,8-naphthyridin-2-yl)-5-ethoxyfuran-2-carboxamide
CID 18524750
4-methylquinoline-2-carbaldehyde
CID 12735795
N-[5-(2-chloro-5-hydroxy-4-methylanilino)-1,8-naphthyridin-2-yl]acetamide;hydrochloride
CID 139855089
(6-formyl-2-pyridinyl)carbamic acid
CID 87302689
N-[7-(dibromomethyl)-5-methyl-1,8-naphthyridin-2-yl]benzamide;pyrrolidine-2,5-dione
CID 139062414
N-(6-fluoro-4-methyl-2-pyridinyl)acetamide
CID 170575880
N-[5-(3-aminoprop-1-enyl)-6-methyl-2-pyridinyl]acetamide
CID 169464106
methyl 3-(6-acetamido-2-methyl-3-pyridinyl)prop-2-enoate
CID 169479439

Frequently Asked Questions

What is the IUPAC name of N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide?
The IUPAC name of N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide (CID 121016050) is N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide.
What is the SMILES notation for N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide?
The canonical SMILES for N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide is CC(=O)Nc1ccc2c(C)cc(C=O)nc2n1.
What is the InChIKey of N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide?
The InChIKey is DFSPGJHBECPJJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c1-7-5-9(6-16)14-12-10(7)3-4-11(15-12)13-8(2)17/h3-6H,1-2H3,(H,13,14,15,17).
What are the key properties of N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide?
N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide has a molecular weight of 229.24 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-formyl-5-methyl-1,8-naphthyridin-2-yl)acetamide is sourced from PubChem (CID 121016050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).