[4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol

C15H17N3O — CID 63776596

IUPAC[4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol
SMILESCN1CCN(c2ccnc(CO)c2)c2ccccc21
InChIInChI=1S/C15H17N3O/c1-17-8-9-18(15-5-3-2-4-14(15)17)13-6-7-16-12(10-13)11-19/h2-7,10,19H,8-9,11H2,1H3
InChIKeyOAFAYDSRXSPFEF-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.16
Rot. Bonds2

About [4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol

[4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol (PubChem CID 63776596) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is [4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol
PubChem CID63776596
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name[4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol
SMILESCN1CCN(c2ccnc(CO)c2)c2ccccc21
InChIInChI=1S/C15H17N3O/c1-17-8-9-18(15-5-3-2-4-14(15)17)13-6-7-16-12(10-13)11-19/h2-7,10,19H,8-9,11H2,1H3
InChIKeyOAFAYDSRXSPFEF-UHFFFAOYSA-N
XLogP2.16
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 54592826
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CID 121581151
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CID 126815079
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CID 19791130
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CID 19791148
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CID 19791157
CID 19791157

Frequently Asked Questions

What is the IUPAC name of [4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol?
The IUPAC name of [4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol (CID 63776596) is [4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol.
What is the SMILES notation for [4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol?
The canonical SMILES for [4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol is CN1CCN(c2ccnc(CO)c2)c2ccccc21.
What is the InChIKey of [4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol?
The InChIKey is OAFAYDSRXSPFEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-17-8-9-18(15-5-3-2-4-14(15)17)13-6-7-16-12(10-13)11-19/h2-7,10,19H,8-9,11H2,1H3.
What are the key properties of [4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol?
[4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol has a molecular weight of 255.32 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol is sourced from PubChem (CID 63776596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).