N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide

C14H16N2O2 — CID 114230507

IUPACN-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide
SMILESCN(CCCO)C(=O)c1ccc2ccccc2n1
InChIInChI=1S/C14H16N2O2/c1-16(9-4-10-17)14(18)13-8-7-11-5-2-3-6-12(11)15-13/h2-3,5-8,17H,4,9-10H2,1H3
InChIKeyQRCFYABGALAETB-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.69
Rot. Bonds4

About N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide

N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide (PubChem CID 114230507) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide
PubChem CID114230507
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide
SMILESCN(CCCO)C(=O)c1ccc2ccccc2n1
InChIInChI=1S/C14H16N2O2/c1-16(9-4-10-17)14(18)13-8-7-11-5-2-3-6-12(11)15-13/h2-3,5-8,17H,4,9-10H2,1H3
InChIKeyQRCFYABGALAETB-UHFFFAOYSA-N
XLogP1.69
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-methylquinoline-2-carboxamide
CID 19793658
N-[2-[cyclohexyl(methyl)amino]ethyl]-N-methylquinoline-2-carboxamide
CID 71885341
N-(2-bromopropyl)-N-methylquinoline-2-carboxamide
CID 80665612
N-[(2-fluorophenyl)methyl]-N-methylquinoline-2-carboxamide
CID 9409269
N-methyl-N-[2-(2-methylphenoxy)ethyl]quinoline-2-carboxamide
CID 26979234
N-[2-(2-methoxyphenoxy)ethyl]-N-methylquinoline-2-carboxamide
CID 60537120
7-fluoro-N-(2-hydroxyethyl)-N-methylquinoline-2-carboxamide
CID 110485346
N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N-methylquinoline-2-carboxamide
CID 77093849
N-(1H-imidazol-2-ylmethyl)-N-methylquinoline-2-carboxamide
CID 63930575
N-[3-(quinoline-2-carbonylamino)propyl]quinoline-2-carboxamide
CID 11603405
N-(3-aminopropyl)-N-methylquinoxaline-2-carboxamide
CID 113265814
N-[6-(quinoline-2-carbonylamino)hexyl]quinoline-2-carboxamide
CID 139197064

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide?
The IUPAC name of N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide (CID 114230507) is N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide.
What is the SMILES notation for N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide?
The canonical SMILES for N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide is CN(CCCO)C(=O)c1ccc2ccccc2n1.
What is the InChIKey of N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide?
The InChIKey is QRCFYABGALAETB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-16(9-4-10-17)14(18)13-8-7-11-5-2-3-6-12(11)15-13/h2-3,5-8,17H,4,9-10H2,1H3.
What are the key properties of N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide?
N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide has a molecular weight of 244.29 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxypropyl)-N-methylquinoline-2-carboxamide is sourced from PubChem (CID 114230507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).