methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate

C14H15N3O2 — CID 46867253

IUPACmethyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate
SMILESCOC(=O)c1cc2c(N)c3c(nc2nc1C)CCC3
InChIInChI=1S/C14H15N3O2/c1-7-9(14(18)19-2)6-10-12(15)8-4-3-5-11(8)17-13(10)16-7/h6H,3-5H2,1-2H3,(H2,15,16,17)
InChIKeyMQPBTVIMKAUQQC-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.80
Rot. Bonds1

About methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate

methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate (PubChem CID 46867253) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate
PubChem CID46867253
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Namemethyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate
SMILESCOC(=O)c1cc2c(N)c3c(nc2nc1C)CCC3
InChIInChI=1S/C14H15N3O2/c1-7-9(14(18)19-2)6-10-12(15)8-4-3-5-11(8)17-13(10)16-7/h6H,3-5H2,1-2H3,(H2,15,16,17)
InChIKeyMQPBTVIMKAUQQC-UHFFFAOYSA-N
XLogP1.80
TPSA78.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate with MolForge

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Related Compounds

methyl 2-amino-6,7-dihydro-5H-cyclopenta[b]pyridine-4-carboxylate
CID 89272080
methyl 7-amino-6-hydroxy-2,3-dihydro-1H-indene-5-carboxylate
CID 84674999
2,3-dimethoxy-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63351751
5-methoxycarbonyl-2,6-dimethylpyridine-3-carboxylic acid
CID 68669960
methyl 3-amino-6,7-dihydro-5H-cyclopenta[b]pyridine-4-carboxylate
CID 115018976
6-methyl-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride
CID 164616381
3-chloro-5-methoxycarbonyl-6-methylpyridine-2-carboxylic acid
CID 162377384
methyl 2-amino-3,5-dimethylbenzoate
CID 10702497
methyl 4-amino-3-methoxy-2,5-dimethylbenzoate
CID 84780550
5-fluoro-7-methyl-1,2,3,4-tetrahydroacridin-9-amine
CID 55045940
methyl 5-[[2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbonyl(methyl)amino]methyl]-2-methylfuran-3-carboxylate
CID 134016262
methyl 4-[[(1-methylcyclopropyl)amino]methyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-2-carboxylate
CID 175953629

Frequently Asked Questions

What is the IUPAC name of methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate?
The IUPAC name of methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate (CID 46867253) is methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate.
What is the SMILES notation for methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate?
The canonical SMILES for methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate is COC(=O)c1cc2c(N)c3c(nc2nc1C)CCC3.
What is the InChIKey of methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate?
The InChIKey is MQPBTVIMKAUQQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-7-9(14(18)19-2)6-10-12(15)8-4-3-5-11(8)17-13(10)16-7/h6H,3-5H2,1-2H3,(H2,15,16,17).
What are the key properties of methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate?
methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate has a molecular weight of 257.29 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]naphthyridine-3-carboxylate is sourced from PubChem (CID 46867253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).