6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide

C11H15N3O — CID 143703103

IUPAC6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide
SMILESCNc1ccc2c(c1)CCC(C(N)=O)N2
InChIInChI=1S/C11H15N3O/c1-13-8-3-5-9-7(6-8)2-4-10(14-9)11(12)15/h3,5-6,10,13-14H,2,4H2,1H3,(H2,12,15)
InChIKeyBCTLLPQJMQGFMY-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.94
Rot. Bonds2

About 6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide

6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide (PubChem CID 143703103) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide.

Molecular Properties

Compound Name6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide
PubChem CID143703103
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide
SMILESCNc1ccc2c(c1)CCC(C(N)=O)N2
InChIInChI=1S/C11H15N3O/c1-13-8-3-5-9-7(6-8)2-4-10(14-9)11(12)15/h3,5-6,10,13-14H,2,4H2,1H3,(H2,12,15)
InChIKeyBCTLLPQJMQGFMY-UHFFFAOYSA-N
XLogP0.94
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide?
The IUPAC name of 6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide (CID 143703103) is 6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide.
What is the SMILES notation for 6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide?
The canonical SMILES for 6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide is CNc1ccc2c(c1)CCC(C(N)=O)N2.
What is the InChIKey of 6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide?
The InChIKey is BCTLLPQJMQGFMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-13-8-3-5-9-7(6-8)2-4-10(14-9)11(12)15/h3,5-6,10,13-14H,2,4H2,1H3,(H2,12,15).
What are the key properties of 6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide?
6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide has a molecular weight of 205.26 g/mol, XLogP of 0.94, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-1,2,3,4-tetrahydroquinoline-2-carboxamide is sourced from PubChem (CID 143703103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).