1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol

C14H19N3O2 — CID 103875708

IUPAC1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol
SMILESCOCC(O)CCNc1nc2ccccc2nc1C
InChIInChI=1S/C14H19N3O2/c1-10-14(15-8-7-11(18)9-19-2)17-13-6-4-3-5-12(13)16-10/h3-6,11,18H,7-9H2,1-2H3,(H,15,17)
InChIKeyJJLQIAAVRGDDFC-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.75
Rot. Bonds6

About 1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol

1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol (PubChem CID 103875708) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol.

Molecular Properties

Compound Name1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol
PubChem CID103875708
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol
SMILESCOCC(O)CCNc1nc2ccccc2nc1C
InChIInChI=1S/C14H19N3O2/c1-10-14(15-8-7-11(18)9-19-2)17-13-6-4-3-5-12(13)16-10/h3-6,11,18H,7-9H2,1-2H3,(H,15,17)
InChIKeyJJLQIAAVRGDDFC-UHFFFAOYSA-N
XLogP1.75
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methoxy-2-methylpropyl)-3-methylquinoxalin-2-amine
CID 47430216
3-methyl-N-[2-(2-methylprop-2-enoxy)ethyl]quinoxalin-2-amine
CID 115698562
3-methyl-N-(7-methyloctyl)quinoxalin-2-amine
CID 107816078
4-[(3-amino-2-pyridinyl)amino]-1-methoxybutan-2-ol
CID 106243050
1-methoxy-4-[[5-methyl-2-(propylamino)pyrimidin-4-yl]amino]butan-2-ol
CID 106248711
N',N'-dimethyl-N-(3-methylquinoxalin-2-yl)ethane-1,2-diamine
CID 18549044
1-methoxy-3-[methyl-(3-methylquinoxalin-2-yl)amino]propan-2-ol
CID 62375523
N-(3-hydroxy-4-methoxybutyl)quinoxaline-2-carboxamide
CID 103877657
1-(cyclopropylmethoxy)-3-[(3-methylquinoxalin-2-yl)amino]propan-2-ol
CID 133301117
N-[2-[(4-methoxyphenyl)methoxy]ethyl]-3-methylquinoxalin-2-amine
CID 133444704
1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol
CID 75503246
4-[(2-amino-5-chloropyrimidin-4-yl)amino]-1-methoxybutan-2-ol
CID 106248716

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol?
The IUPAC name of 1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol (CID 103875708) is 1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol.
What is the SMILES notation for 1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol?
The canonical SMILES for 1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol is COCC(O)CCNc1nc2ccccc2nc1C.
What is the InChIKey of 1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol?
The InChIKey is JJLQIAAVRGDDFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-10-14(15-8-7-11(18)9-19-2)17-13-6-4-3-5-12(13)16-10/h3-6,11,18H,7-9H2,1-2H3,(H,15,17).
What are the key properties of 1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol?
1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol has a molecular weight of 261.32 g/mol, XLogP of 1.75, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol is sourced from PubChem (CID 103875708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).