N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine

C15H28N4O2 — CID 66451039

IUPACN-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine
SMILESCOCCCN(CCOC)c1cncc(CNC(C)C)n1
InChIInChI=1S/C15H28N4O2/c1-13(2)17-11-14-10-16-12-15(18-14)19(7-9-21-4)6-5-8-20-3/h10,12-13,17H,5-9,11H2,1-4H3
InChIKeyJTMIKQGUHMUTTE-UHFFFAOYSA-N
MW296.42 g/mol
LogP1.46
Rot. Bonds11

About N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine

N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine (PubChem CID 66451039) has the molecular formula C15H28N4O2 and a molecular weight of 296.42 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine
PubChem CID66451039
Molecular FormulaC15H28N4O2
Molecular Weight296.42 g/mol
Exact Mass296.22
IUPAC NameN-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine
SMILESCOCCCN(CCOC)c1cncc(CNC(C)C)n1
InChIInChI=1S/C15H28N4O2/c1-13(2)17-11-14-10-16-12-15(18-14)19(7-9-21-4)6-5-8-20-3/h10,12-13,17H,5-9,11H2,1-4H3
InChIKeyJTMIKQGUHMUTTE-UHFFFAOYSA-N
XLogP1.46
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-6-N-methylpyrazine-2,6-diamine
CID 80806190
N-pentyl-N-propan-2-yl-6-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 66450851
N-methyl-6-[(propan-2-ylamino)methyl]-N-(2-propan-2-yloxyethyl)pyrazin-2-amine
CID 81075073
5-chloro-N,N-bis(2-methoxyethyl)-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 114926132
N-ethyl-N-methyl-6-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 66456595
N-butan-2-yl-N-(2-methoxyethyl)-6-(methylaminomethyl)pyrazin-2-amine
CID 66451443
N-(3-methoxypropyl)-N-methyl-6-(propylaminomethyl)pyrazin-2-amine
CID 66450496
N-cyclopentyl-N-methyl-6-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 66458175
6-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-propan-2-ylpyrazin-2-amine
CID 82953034
6-(aminomethyl)-N-(3-methoxypropyl)-N-methylpyrazin-2-amine
CID 66450103
6-(ethylaminomethyl)-N-(2-methoxyethyl)-N-pentan-3-ylpyrazin-2-amine
CID 66451454
N-[(6-butoxypyrazin-2-yl)methyl]propan-2-amine
CID 66451389

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine?
The IUPAC name of N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine (CID 66451039) is N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine is COCCCN(CCOC)c1cncc(CNC(C)C)n1.
What is the InChIKey of N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine?
The InChIKey is JTMIKQGUHMUTTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-13(2)17-11-14-10-16-12-15(18-14)19(7-9-21-4)6-5-8-20-3/h10,12-13,17H,5-9,11H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine?
N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine has a molecular weight of 296.42 g/mol, XLogP of 1.46, 11 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-[(propan-2-ylamino)methyl]pyrazin-2-amine is sourced from PubChem (CID 66451039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).