N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide

C15H20N4O — CID 107206630

IUPACN-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide
SMILESCN(CCCCCN)C(=O)c1cccc2nccnc12
InChIInChI=1S/C15H20N4O/c1-19(11-4-2-3-8-16)15(20)12-6-5-7-13-14(12)18-10-9-17-13/h5-7,9-10H,2-4,8,11,16H2,1H3
InChIKeyYLCKPSFXHOHTJX-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.83
Rot. Bonds6

About N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide

N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide (PubChem CID 107206630) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide.

Molecular Properties

Compound NameN-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide
PubChem CID107206630
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide
SMILESCN(CCCCCN)C(=O)c1cccc2nccnc12
InChIInChI=1S/C15H20N4O/c1-19(11-4-2-3-8-16)15(20)12-6-5-7-13-14(12)18-10-9-17-13/h5-7,9-10H,2-4,8,11,16H2,1H3
InChIKeyYLCKPSFXHOHTJX-UHFFFAOYSA-N
XLogP1.83
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.83
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

2-[methyl(quinoxaline-5-carbonyl)amino]acetic acid
CID 104614064
N-(2-aminoethyl)-N-cyclopropylquinoxaline-5-carboxamide
CID 104613988
(2S)-2,6-diaminohexanoic acid;quinoxaline-5-carboxamide
CID 157131879
N-(1-bromopropan-2-yl)-N-methylquinoxaline-5-carboxamide
CID 104615787
N-(3-aminopropyl)-2-iodo-N-methylbenzamide
CID 81483846
N-(4-aminobutyl)-N-methylbenzamide
CID 119088367
N-propyl-N-prop-2-ynylquinoxaline-5-carboxamide
CID 104577691
N-(4-aminobutan-2-yl)quinoxaline-5-carboxamide
CID 104613993
ethyl 2-[ethyl(quinoxaline-5-carbonyl)amino]acetate
CID 104577671
N-(3-aminopropyl)-N-propylquinoline-8-carboxamide
CID 62849856
N-(3-aminopropyl)-N-methylquinoxaline-2-carboxamide
CID 113265814
N-(5-aminopentyl)-N,5-dimethyl-1H-pyrazole-4-carboxamide
CID 107206762

Frequently Asked Questions

What is the IUPAC name of N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide?
The IUPAC name of N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide (CID 107206630) is N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide.
What is the SMILES notation for N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide?
The canonical SMILES for N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide is CN(CCCCCN)C(=O)c1cccc2nccnc12.
What is the InChIKey of N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide?
The InChIKey is YLCKPSFXHOHTJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-19(11-4-2-3-8-16)15(20)12-6-5-7-13-14(12)18-10-9-17-13/h5-7,9-10H,2-4,8,11,16H2,1H3.
What are the key properties of N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide?
N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 1.83, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-aminopentyl)-N-methylquinoxaline-5-carboxamide is sourced from PubChem (CID 107206630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).