N-(5-hydroxypentyl)quinoline-4-carboxamide

C15H18N2O2 — CID 107318423

IUPACN-(5-hydroxypentyl)quinoline-4-carboxamide
SMILESO=C(NCCCCCO)c1ccnc2ccccc12
InChIInChI=1S/C15H18N2O2/c18-11-5-1-4-9-17-15(19)13-8-10-16-14-7-3-2-6-12(13)14/h2-3,6-8,10,18H,1,4-5,9,11H2,(H,17,19)
InChIKeyARMSFYCFVFNTPG-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.13
Rot. Bonds6

About N-(5-hydroxypentyl)quinoline-4-carboxamide

N-(5-hydroxypentyl)quinoline-4-carboxamide (PubChem CID 107318423) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(5-hydroxypentyl)quinoline-4-carboxamide.

Molecular Properties

Compound NameN-(5-hydroxypentyl)quinoline-4-carboxamide
PubChem CID107318423
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-(5-hydroxypentyl)quinoline-4-carboxamide
SMILESO=C(NCCCCCO)c1ccnc2ccccc12
InChIInChI=1S/C15H18N2O2/c18-11-5-1-4-9-17-15(19)13-8-10-16-14-7-3-2-6-12(13)14/h2-3,6-8,10,18H,1,4-5,9,11H2,(H,17,19)
InChIKeyARMSFYCFVFNTPG-UHFFFAOYSA-N
XLogP2.13
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-iodopropyl)quinoline-4-carboxamide
CID 114504474
N-(4-azidobutyl)quinoline-4-carboxamide
CID 106386810
2-chloro-N-(5-hydroxypentyl)quinoline-4-carboxamide
CID 107317154
N-[3-(2-aminoethoxy)propyl]quinoline-4-carboxamide
CID 106307902
N-(2-oxoethyl)quinoline-4-carboxamide
CID 138723013
N-[2-(benzenesulfonyl)ethyl]quinoline-4-carboxamide
CID 60515386
N-[2-(1H-benzimidazol-2-yl)ethyl]quinoline-4-carboxamide
CID 59018404
N-(3-methoxypropyl)quinoline-5-carboxamide
CID 51075711
1-[(quinoline-4-carbonylamino)methyl]cyclopropane-1-carboxylic acid
CID 115449424
2-chloro-N-(11-hydroxyundecyl)pyridine-3-carboxamide
CID 19791110
N-[3-(N-ethylanilino)propyl]quinoline-5-carboxamide
CID 26035305
N-(4-hydroxypentyl)quinoline-5-carboxamide
CID 107300441

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxypentyl)quinoline-4-carboxamide?
The IUPAC name of N-(5-hydroxypentyl)quinoline-4-carboxamide (CID 107318423) is N-(5-hydroxypentyl)quinoline-4-carboxamide.
What is the SMILES notation for N-(5-hydroxypentyl)quinoline-4-carboxamide?
The canonical SMILES for N-(5-hydroxypentyl)quinoline-4-carboxamide is O=C(NCCCCCO)c1ccnc2ccccc12.
What is the InChIKey of N-(5-hydroxypentyl)quinoline-4-carboxamide?
The InChIKey is ARMSFYCFVFNTPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c18-11-5-1-4-9-17-15(19)13-8-10-16-14-7-3-2-6-12(13)14/h2-3,6-8,10,18H,1,4-5,9,11H2,(H,17,19).
What are the key properties of N-(5-hydroxypentyl)quinoline-4-carboxamide?
N-(5-hydroxypentyl)quinoline-4-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.13, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxypentyl)quinoline-4-carboxamide is sourced from PubChem (CID 107318423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).