methyl 2-aminoquinoline-7-carboxylate

C11H10N2O2 — CID 118266696

IUPACmethyl 2-aminoquinoline-7-carboxylate
SMILESCOC(=O)c1ccc2ccc(N)nc2c1
InChIInChI=1S/C11H10N2O2/c1-15-11(14)8-3-2-7-4-5-10(12)13-9(7)6-8/h2-6H,1H3,(H2,12,13)
InChIKeyDAIVBFTZOWMKHT-UHFFFAOYSA-N
MW202.21 g/mol
LogP1.60
Rot. Bonds1

About methyl 2-aminoquinoline-7-carboxylate

methyl 2-aminoquinoline-7-carboxylate (PubChem CID 118266696) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is methyl 2-aminoquinoline-7-carboxylate.

Molecular Properties

Compound Namemethyl 2-aminoquinoline-7-carboxylate
PubChem CID118266696
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Namemethyl 2-aminoquinoline-7-carboxylate
SMILESCOC(=O)c1ccc2ccc(N)nc2c1
InChIInChI=1S/C11H10N2O2/c1-15-11(14)8-3-2-7-4-5-10(12)13-9(7)6-8/h2-6H,1H3,(H2,12,13)
InChIKeyDAIVBFTZOWMKHT-UHFFFAOYSA-N
XLogP1.60
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-(bromomethyl)quinoline-7-carboxylate
CID 168980645
methyl 2-(2-bromophenyl)quinoline-7-carboxylate
CID 169130575
methyl 3-bromoquinoline-7-carboxylate
CID 117100290
methyl phenazine-2-carboxylate
CID 617185
methyl 2-methoxyindazole-6-carboxylate
CID 141268418
ethyl 2-chloroquinoline-7-carboxylate
CID 72942632
methyl 3-amino-4-[2-(2-amino-4-methoxycarbonylphenyl)ethenyl]benzoate
CID 91202728
methyl 2H-benzotriazole-5-carboxylate
CID 6409672
methyl 7-chlorophenazine-2-carboxylate
CID 154715967
6-methoxycarbonylnaphthalene-2-carboxylate
CID 3934911
ethane;methyl naphthalene-2-carboxylate
CID 143895262
methyl 2-methylperoxy-1,3-benzoxazole-5-carboxylate
CID 59027145

Frequently Asked Questions

What is the IUPAC name of methyl 2-aminoquinoline-7-carboxylate?
The IUPAC name of methyl 2-aminoquinoline-7-carboxylate (CID 118266696) is methyl 2-aminoquinoline-7-carboxylate.
What is the SMILES notation for methyl 2-aminoquinoline-7-carboxylate?
The canonical SMILES for methyl 2-aminoquinoline-7-carboxylate is COC(=O)c1ccc2ccc(N)nc2c1.
What is the InChIKey of methyl 2-aminoquinoline-7-carboxylate?
The InChIKey is DAIVBFTZOWMKHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-15-11(14)8-3-2-7-4-5-10(12)13-9(7)6-8/h2-6H,1H3,(H2,12,13).
What are the key properties of methyl 2-aminoquinoline-7-carboxylate?
methyl 2-aminoquinoline-7-carboxylate has a molecular weight of 202.21 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-aminoquinoline-7-carboxylate is sourced from PubChem (CID 118266696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).