N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine

C14H18N4O — CID 66451348

IUPACN-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine
SMILESCc1ccc(Oc2cncc(CNC(C)C)n2)cn1
InChIInChI=1S/C14H18N4O/c1-10(2)16-7-12-6-15-9-14(18-12)19-13-5-4-11(3)17-8-13/h4-6,8-10,16H,7H2,1-3H3
InChIKeyIOWMZRBHJIJOBO-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.47
Rot. Bonds5

About N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine

N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine (PubChem CID 66451348) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine
PubChem CID66451348
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine
SMILESCc1ccc(Oc2cncc(CNC(C)C)n2)cn1
InChIInChI=1S/C14H18N4O/c1-10(2)16-7-12-6-15-9-14(18-12)19-13-5-4-11(3)17-8-13/h4-6,8-10,16H,7H2,1-3H3
InChIKeyIOWMZRBHJIJOBO-UHFFFAOYSA-N
XLogP2.47
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine?
The IUPAC name of N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine (CID 66451348) is N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine is Cc1ccc(Oc2cncc(CNC(C)C)n2)cn1.
What is the InChIKey of N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine?
The InChIKey is IOWMZRBHJIJOBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-10(2)16-7-12-6-15-9-14(18-12)19-13-5-4-11(3)17-8-13/h4-6,8-10,16H,7H2,1-3H3.
What are the key properties of N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine?
N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine has a molecular weight of 258.32 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 66451348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).