N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine

C13H15N3O — CID 33370324

IUPACN-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine
SMILESc1ccc2nc(NC[C@H]3CCCO3)cnc2c1
InChIInChI=1S/C13H15N3O/c1-2-6-12-11(5-1)14-9-13(16-12)15-8-10-4-3-7-17-10/h1-2,5-6,9-10H,3-4,7-8H2,(H,15,16)/t10-/m1/s1
InChIKeyDOJZWRZMQRRICS-SNVBAGLBSA-N
MW229.28 g/mol
LogP2.22
Rot. Bonds3

About N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine

N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine (PubChem CID 33370324) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine.

Molecular Properties

Compound NameN-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine
PubChem CID33370324
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC NameN-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine
SMILESc1ccc2nc(NC[C@H]3CCCO3)cnc2c1
InChIInChI=1S/C13H15N3O/c1-2-6-12-11(5-1)14-9-13(16-12)15-8-10-4-3-7-17-10/h1-2,5-6,9-10H,3-4,7-8H2,(H,15,16)/t10-/m1/s1
InChIKeyDOJZWRZMQRRICS-SNVBAGLBSA-N
XLogP2.22
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,4-dioxan-2-ylmethyl)quinoxalin-2-amine
CID 47292946
N-(oxan-4-ylmethyl)quinoxalin-2-amine
CID 62351550
N-[[(2R)-4-ethylmorpholin-2-yl]methyl]quinoxalin-2-amine
CID 95319257
N-[[(2S)-4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methyl]quinoxalin-2-amine
CID 100668614
N-[(2-aminocyclohexyl)methyl]quinoxalin-2-amine
CID 64926894
4-N-cycloheptyl-6-N-(oxolan-2-ylmethyl)-2-phenylpyrimidine-4,6-diamine
CID 112880638
5-methyl-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 43104324
N-[[(2S)-piperidin-2-yl]methyl]quinoxalin-2-amine
CID 94416055
6-bromo-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 63961095
5-bromo-N-[[(2R)-oxolan-2-yl]methyl]pyridin-2-amine
CID 29266636
5-bromo-N-[[(2S)-oxolan-2-yl]methyl]pyridin-2-amine
CID 29266634
4-N,6-N-bis(oxolan-2-ylmethyl)pyrimidine-4,6-diamine
CID 112857188

Frequently Asked Questions

What is the IUPAC name of N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine?
The IUPAC name of N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine (CID 33370324) is N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine.
What is the SMILES notation for N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine?
The canonical SMILES for N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine is c1ccc2nc(NC[C@H]3CCCO3)cnc2c1.
What is the InChIKey of N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine?
The InChIKey is DOJZWRZMQRRICS-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H15N3O/c1-2-6-12-11(5-1)14-9-13(16-12)15-8-10-4-3-7-17-10/h1-2,5-6,9-10H,3-4,7-8H2,(H,15,16)/t10-/m1/s1.
What are the key properties of N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine?
N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine has a molecular weight of 229.28 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R)-oxolan-2-yl]methyl]quinoxalin-2-amine is sourced from PubChem (CID 33370324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).