8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide

C15H18N2O2 — CID 110489872

IUPAC8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide
SMILESCOc1cccc2cc(C(=O)NCC(C)C)cnc12
InChIInChI=1S/C15H18N2O2/c1-10(2)8-17-15(18)12-7-11-5-4-6-13(19-3)14(11)16-9-12/h4-7,9-10H,8H2,1-3H3,(H,17,18)
InChIKeyXIWRUZVHWVPIAH-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.63
Rot. Bonds4

About 8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide

8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide (PubChem CID 110489872) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide.

Molecular Properties

Compound Name8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide
PubChem CID110489872
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide
SMILESCOc1cccc2cc(C(=O)NCC(C)C)cnc12
InChIInChI=1S/C15H18N2O2/c1-10(2)8-17-15(18)12-7-11-5-4-6-13(19-3)14(11)16-9-12/h4-7,9-10H,8H2,1-3H3,(H,17,18)
InChIKeyXIWRUZVHWVPIAH-UHFFFAOYSA-N
XLogP2.63
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-hydroxy-2-methylpropan-2-yl)-8-methoxyquinoline-3-carboxamide
CID 110489878
N-(2,4-dimethyl-1-phenylpentan-2-yl)-8-methoxyquinoline-3-carboxamide
CID 130421212
7-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide
CID 110489915
8-methoxy-N-(4-methylcyclohexyl)quinoline-3-carboxamide
CID 22136433
2-[(2-methoxyphenyl)methylamino]-N-(2-methylpropyl)pyrimidine-5-carboxamide
CID 109248461
N-(2-methylpropyl)furo[2,3-b]pyridine-5-carboxamide
CID 176825419
methyl 2-[(8-chloroquinoline-3-carbonyl)amino]acetate
CID 110490110
methyl 3-[(8-fluoroquinoline-3-carbonyl)amino]propanoate
CID 110489648
N-(2-methylpropyl)-6-(3,4,5-trimethoxyanilino)pyridine-3-carboxamide
CID 109151937
methyl 3-(2-methylpropylcarbamoyl)benzoate
CID 108786629
7,8-difluoro-N-(2-hydroxypropyl)quinoline-3-carboxamide
CID 110490043
N-(2-methylpropyl)isoquinoline-3-carboxamide
CID 110848375

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide?
The IUPAC name of 8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide (CID 110489872) is 8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide.
What is the SMILES notation for 8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide?
The canonical SMILES for 8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide is COc1cccc2cc(C(=O)NCC(C)C)cnc12.
What is the InChIKey of 8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide?
The InChIKey is XIWRUZVHWVPIAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-10(2)8-17-15(18)12-7-11-5-4-6-13(19-3)14(11)16-9-12/h4-7,9-10H,8H2,1-3H3,(H,17,18).
What are the key properties of 8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide?
8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide is sourced from PubChem (CID 110489872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).