N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide

C15H18N2O3 — CID 95972027

IUPACN-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide
SMILESCOc1ccc2nc(C(=O)N(C)C[C@@H](C)O)ccc2c1
InChIInChI=1S/C15H18N2O3/c1-10(18)9-17(2)15(19)14-6-4-11-8-12(20-3)5-7-13(11)16-14/h4-8,10,18H,9H2,1-3H3/t10-/m1/s1
InChIKeyQVVDEXHLEUBRMP-SNVBAGLBSA-N
MW274.32 g/mol
LogP1.70
Rot. Bonds4

About N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide

N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide (PubChem CID 95972027) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide
PubChem CID95972027
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC NameN-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide
SMILESCOc1ccc2nc(C(=O)N(C)C[C@@H](C)O)ccc2c1
InChIInChI=1S/C15H18N2O3/c1-10(18)9-17(2)15(19)14-6-4-11-8-12(20-3)5-7-13(11)16-14/h4-8,10,18H,9H2,1-3H3/t10-/m1/s1
InChIKeyQVVDEXHLEUBRMP-SNVBAGLBSA-N
XLogP1.70
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-hydroxycyclopentyl)methyl]-6-methoxy-N-methylquinoline-2-carboxamide
CID 109399670
N-[(5-bromothiophen-3-yl)methyl]-6-methoxy-N-methylquinoline-2-carboxamide
CID 86839473
N-ethyl-N-(2-hydroxyethyl)-6-methoxyquinoline-2-carboxamide
CID 110886561
N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylquinoline-2-carboxamide
CID 9482645
N-ethyl-6-methoxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]quinoline-2-carboxamide
CID 24586114
N-[3-(1H-benzimidazol-2-yl)propyl]-6-methoxy-N-methylquinoline-2-carboxamide
CID 86859939
N-[[4-(dimethylamino)phenyl]methyl]-6-methoxyquinoline-2-carboxamide
CID 33318425
N-benzyl-N-cyclopropyl-6-methoxyquinoline-2-carboxamide
CID 38283237
N-(2-bromopropyl)-N-methylquinoline-2-carboxamide
CID 80665612
N-(2-hydroxypropyl)-2-(4-methoxyphenyl)-N-methylacetamide
CID 62333656
N-(2-hydroxypropyl)-2-(4-methoxyphenoxy)-N-methylacetamide
CID 62334405
[2-oxo-2-(pentan-2-ylamino)ethyl] 6-methoxyquinoline-2-carboxylate
CID 16581486

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide?
The IUPAC name of N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide (CID 95972027) is N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide.
What is the SMILES notation for N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide?
The canonical SMILES for N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide is COc1ccc2nc(C(=O)N(C)C[C@@H](C)O)ccc2c1.
What is the InChIKey of N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide?
The InChIKey is QVVDEXHLEUBRMP-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-10(18)9-17(2)15(19)14-6-4-11-8-12(20-3)5-7-13(11)16-14/h4-8,10,18H,9H2,1-3H3/t10-/m1/s1.
What are the key properties of N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide?
N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 1.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-hydroxypropyl]-6-methoxy-N-methylquinoline-2-carboxamide is sourced from PubChem (CID 95972027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).