2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol

C15H25N3O — CID 64789194

IUPAC2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol
SMILESCCNC(CO)CCN1CCN(C)c2ccccc21
InChIInChI=1S/C15H25N3O/c1-3-16-13(12-19)8-9-18-11-10-17(2)14-6-4-5-7-15(14)18/h4-7,13,16,19H,3,8-12H2,1-2H3
InChIKeyYTUYIAMIIDBSMK-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.30
Rot. Bonds6

About 2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol

2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol (PubChem CID 64789194) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol.

Molecular Properties

Compound Name2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol
PubChem CID64789194
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol
SMILESCCNC(CO)CCN1CCN(C)c2ccccc21
InChIInChI=1S/C15H25N3O/c1-3-16-13(12-19)8-9-18-11-10-17(2)14-6-4-5-7-15(14)18/h4-7,13,16,19H,3,8-12H2,1-2H3
InChIKeyYTUYIAMIIDBSMK-UHFFFAOYSA-N
XLogP1.30
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol?
The IUPAC name of 2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol (CID 64789194) is 2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol.
What is the SMILES notation for 2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol?
The canonical SMILES for 2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol is CCNC(CO)CCN1CCN(C)c2ccccc21.
What is the InChIKey of 2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol?
The InChIKey is YTUYIAMIIDBSMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-3-16-13(12-19)8-9-18-11-10-17(2)14-6-4-5-7-15(14)18/h4-7,13,16,19H,3,8-12H2,1-2H3.
What are the key properties of 2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol?
2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol has a molecular weight of 263.38 g/mol, XLogP of 1.30, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-ol is sourced from PubChem (CID 64789194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).