N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine

C15H28N4O — CID 107380720

IUPACN-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine
SMILESCOCCN(c1cnc(CNCC(C)C)cn1)C(C)C
InChIInChI=1S/C15H28N4O/c1-12(2)8-16-9-14-10-18-15(11-17-14)19(13(3)4)6-7-20-5/h10-13,16H,6-9H2,1-5H3
InChIKeyCUXSUMXLBLFLEZ-UHFFFAOYSA-N
MW280.42 g/mol
LogP2.08
Rot. Bonds9

About N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine

N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine (PubChem CID 107380720) has the molecular formula C15H28N4O and a molecular weight of 280.42 g/mol. Its IUPAC name is N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine
PubChem CID107380720
Molecular FormulaC15H28N4O
Molecular Weight280.42 g/mol
Exact Mass280.23
IUPAC NameN-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine
SMILESCOCCN(c1cnc(CNCC(C)C)cn1)C(C)C
InChIInChI=1S/C15H28N4O/c1-12(2)8-16-9-14-10-18-15(11-17-14)19(13(3)4)6-7-20-5/h10-13,16H,6-9H2,1-5H3
InChIKeyCUXSUMXLBLFLEZ-UHFFFAOYSA-N
XLogP2.08
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyridin-2-amine
CID 82960066
N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
CID 107378992
N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-prop-2-enylpyrazin-2-amine
CID 107381055
N-[(5-methoxypyrazin-2-yl)methyl]-2-methylpropan-1-amine
CID 107381363
5-(methylaminomethyl)-N-propan-2-yl-N-propylpyrazin-2-amine
CID 107379107
N-(3-fluorophenyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
CID 107379672
N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62295141
N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-pentan-3-yl-1,3-thiazol-2-amine
CID 62752928
N-(2-methoxyethyl)-N-propan-2-yl-6-(propylaminomethyl)pyridazin-3-amine
CID 82953348
5-(ethylaminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyrazin-2-amine
CID 107379629
N-benzyl-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
CID 107378891
N-cyclopropyl-N-(2-methoxyethyl)-6-[(2-methylpropylamino)methyl]pyridazin-3-amine
CID 62292853

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine?
The IUPAC name of N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine (CID 107380720) is N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine is COCCN(c1cnc(CNCC(C)C)cn1)C(C)C.
What is the InChIKey of N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine?
The InChIKey is CUXSUMXLBLFLEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O/c1-12(2)8-16-9-14-10-18-15(11-17-14)19(13(3)4)6-7-20-5/h10-13,16H,6-9H2,1-5H3.
What are the key properties of N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine?
N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine has a molecular weight of 280.42 g/mol, XLogP of 2.08, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyrazin-2-amine is sourced from PubChem (CID 107380720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).