3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid

C9H11N3O2 — CID 175443625

IUPAC3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid
SMILESNc1cnc2c(c1)CCN(C(=O)O)C2
InChIInChI=1S/C9H11N3O2/c10-7-3-6-1-2-12(9(13)14)5-8(6)11-4-7/h3-4H,1-2,5,10H2,(H,13,14)
InChIKeyJRKRROWITGTSBV-UHFFFAOYSA-N
MW193.21 g/mol
LogP0.70
Rot. Bonds

About 3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid

3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid (PubChem CID 175443625) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is 3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid.

Molecular Properties

Compound Name3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid
PubChem CID175443625
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC Name3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid
SMILESNc1cnc2c(c1)CCN(C(=O)O)C2
InChIInChI=1S/C9H11N3O2/c10-7-3-6-1-2-12(9(13)14)5-8(6)11-4-7/h3-4H,1-2,5,10H2,(H,13,14)
InChIKeyJRKRROWITGTSBV-UHFFFAOYSA-N
XLogP0.70
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-amino-7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethanone
CID 69424274
6-amino-3,4-dihydro-1H-2,7-naphthyridine-2-carboxylic acid
CID 70299304
2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxylic acid
CID 83835396
3,4-dihydro-1H-2,6-naphthyridine-2,7-dicarboxylic acid
CID 155143574
7-(aminomethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid
CID 175467955
3-(trifluoromethyl)-7,8-dihydro-5H-1,6-naphthyridine-6-carboxylic acid
CID 174750188
N-hydroxy-7-[2-(methylamino)acetyl]-6,8-dihydro-5H-1,7-naphthyridine-3-carboxamide
CID 87147895
6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine
CID 10630532
tert-butyl 3-amino-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate;tert-butyl 3-bromo-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate
CID 159373493
7-O-tert-butyl 3-O-methyl 6,8-dihydro-5H-1,7-naphthyridine-3,7-dicarboxylate
CID 53446461
2,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxylic acid
CID 68725346
7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid
CID 146273702

Frequently Asked Questions

What is the IUPAC name of 3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid?
The IUPAC name of 3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid (CID 175443625) is 3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid.
What is the SMILES notation for 3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid?
The canonical SMILES for 3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid is Nc1cnc2c(c1)CCN(C(=O)O)C2.
What is the InChIKey of 3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid?
The InChIKey is JRKRROWITGTSBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c10-7-3-6-1-2-12(9(13)14)5-8(6)11-4-7/h3-4H,1-2,5,10H2,(H,13,14).
What are the key properties of 3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid?
3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid has a molecular weight of 193.21 g/mol, XLogP of 0.70, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6,8-dihydro-5H-1,7-naphthyridine-7-carboxylic acid is sourced from PubChem (CID 175443625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).