N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide

C16H15N3O2 — CID 74240216

IUPACN-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide
SMILESO=C(NCCCc1ccco1)c1ccc2nccnc2c1
InChIInChI=1S/C16H15N3O2/c20-16(19-7-1-3-13-4-2-10-21-13)12-5-6-14-15(11-12)18-9-8-17-14/h2,4-6,8-11H,1,3,7H2,(H,19,20)
InChIKeyIDPLUUUXOQPXAR-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.59
Rot. Bonds5

About N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide

N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide (PubChem CID 74240216) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide.

Molecular Properties

Compound NameN-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide
PubChem CID74240216
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC NameN-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide
SMILESO=C(NCCCc1ccco1)c1ccc2nccnc2c1
InChIInChI=1S/C16H15N3O2/c20-16(19-7-1-3-13-4-2-10-21-13)12-5-6-14-15(11-12)18-9-8-17-14/h2,4-6,8-11H,1,3,7H2,(H,19,20)
InChIKeyIDPLUUUXOQPXAR-UHFFFAOYSA-N
XLogP2.59
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(furan-2-yl)ethyl]-2H-benzotriazole-5-carboxamide
CID 18126076
N-(3-bromopropyl)quinoxaline-6-carboxamide
CID 62874705
N-(2-phenylethyl)quinoxaline-6-carboxamide
CID 858929
N-[2-(furan-2-yl)ethyl]-4-(pyrimidin-2-ylamino)benzamide
CID 71708375
N-(4-aminopentyl)quinoxaline-6-carboxamide
CID 106122838
N-[3-(furan-2-yl)propyl]-3-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 176504746
N-[(2-aminophenyl)methyl]quinoxaline-6-carboxamide
CID 62849872
N-[3-(furan-2-yl)propyl]-4-morpholin-4-ylbenzamide
CID 53282150
N-(5-amino-5-hydroxyiminopentyl)quinoxaline-6-carboxamide
CID 77036760
N-[3-(furan-2-yl)propyl]-2,5-dimethylbenzamide
CID 100623229
2-amino-6-chloro-N-[2-(furan-2-yl)ethyl]pyridine-4-carboxamide
CID 62161577
N-(furan-2-ylmethyl)-2-quinoxalin-6-yloxyacetamide
CID 51362583

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide?
The IUPAC name of N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide (CID 74240216) is N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide.
What is the SMILES notation for N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide?
The canonical SMILES for N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide is O=C(NCCCc1ccco1)c1ccc2nccnc2c1.
What is the InChIKey of N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide?
The InChIKey is IDPLUUUXOQPXAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c20-16(19-7-1-3-13-4-2-10-21-13)12-5-6-14-15(11-12)18-9-8-17-14/h2,4-6,8-11H,1,3,7H2,(H,19,20).
What are the key properties of N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide?
N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide has a molecular weight of 281.31 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide is sourced from PubChem (CID 74240216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).