6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one

C10H10ClN3O — CID 163320790

IUPAC6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one
SMILESCN(C)c1nc(Cl)cc2cc[nH]c(=O)c12
InChIInChI=1S/C10H10ClN3O/c1-14(2)9-8-6(5-7(11)13-9)3-4-12-10(8)15/h3-5H,1-2H3,(H,12,15)
InChIKeyQECLVKUARFRYPZ-UHFFFAOYSA-N
MW223.66 g/mol
LogP1.64
Rot. Bonds1

About 6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one

6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one (PubChem CID 163320790) has the molecular formula C10H10ClN3O and a molecular weight of 223.66 g/mol. Its IUPAC name is 6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one.

Molecular Properties

Compound Name6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one
PubChem CID163320790
Molecular FormulaC10H10ClN3O
Molecular Weight223.66 g/mol
Exact Mass223.05
IUPAC Name6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one
SMILESCN(C)c1nc(Cl)cc2cc[nH]c(=O)c12
InChIInChI=1S/C10H10ClN3O/c1-14(2)9-8-6(5-7(11)13-9)3-4-12-10(8)15/h3-5H,1-2H3,(H,12,15)
InChIKeyQECLVKUARFRYPZ-UHFFFAOYSA-N
XLogP1.64
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.66
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-chloro-8-(propan-2-ylamino)-2H-2,7-naphthyridin-1-one
CID 58166804
6-(dimethylamino)-2H-isoquinolin-1-one
CID 57424142
8-amino-6-methyl-2H-2,7-naphthyridin-1-one;ethane
CID 143841168
6-bromo-7,8-difluoro-2H-isoquinolin-1-one
CID 169118375
3-chloro-N,N-dimethylisoquinolin-1-amine
CID 57431935
6-chloro-8-(4-pyridin-3-ylanilino)-2H-2,7-naphthyridin-1-one
CID 58094086
6-chloro-8-(4-morpholin-4-ylanilino)-2H-2,7-naphthyridin-1-one
CID 86649544
6-methyl-2H-benzo[h]isoquinolin-1-one
CID 10465683
6,8-dibromo-2H-isoquinolin-1-one
CID 146049016
8-methyl-6-phenyl-2H-2,7-naphthyridin-1-one
CID 11948308
8-amino-6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one
CID 58094010
CID 88863341
CID 88863341

Frequently Asked Questions

What is the IUPAC name of 6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one?
The IUPAC name of 6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one (CID 163320790) is 6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one.
What is the SMILES notation for 6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one?
The canonical SMILES for 6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one is CN(C)c1nc(Cl)cc2cc[nH]c(=O)c12.
What is the InChIKey of 6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one?
The InChIKey is QECLVKUARFRYPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3O/c1-14(2)9-8-6(5-7(11)13-9)3-4-12-10(8)15/h3-5H,1-2H3,(H,12,15).
What are the key properties of 6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one?
6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one has a molecular weight of 223.66 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-8-(dimethylamino)-2H-2,7-naphthyridin-1-one is sourced from PubChem (CID 163320790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).