N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine

C11H15N5 — CID 79738561

IUPACN-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
SMILESCCNc1nccnc1Cc1nccn1C
InChIInChI=1S/C11H15N5/c1-3-12-11-9(13-4-5-15-11)8-10-14-6-7-16(10)2/h4-7H,3,8H2,1-2H3,(H,12,15)
InChIKeySUMQNBKXWMPODO-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.23
Rot. Bonds4

About N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine

N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine (PubChem CID 79738561) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
PubChem CID79738561
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC NameN-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
SMILESCCNc1nccnc1Cc1nccn1C
InChIInChI=1S/C11H15N5/c1-3-12-11-9(13-4-5-15-11)8-10-14-6-7-16(10)2/h4-7H,3,8H2,1-2H3,(H,12,15)
InChIKeySUMQNBKXWMPODO-UHFFFAOYSA-N
XLogP1.23
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-5-methyl-6-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 79738756
N-ethyl-6-[(1-methylimidazol-2-yl)methyl]-5-nitropyrimidin-4-amine
CID 79738662
N-ethyl-3-[(1-methylbenzimidazol-2-yl)methyl]pyrazin-2-amine
CID 79754406
3-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
CID 83062959
N-ethyl-6-[(1-ethylimidazol-2-yl)methyl]-5-propylpyrimidin-4-amine
CID 79738464
3-[(1-methylimidazol-2-yl)methylamino]pyrazine-2-carbonitrile
CID 63239072
azane;1-methyl-2-propylimidazole
CID 174525892
4-N-ethyl-2-N,2-N-dimethyl-6-[(1-methylimidazol-2-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 79738059
methanamine;1-methyl-2-propylimidazole
CID 164902083
3-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]pentan-3-amine
CID 106328740
2-N-ethyl-5-fluoro-4-N-[(1-methylimidazol-2-yl)methyl]pyrimidine-2,4-diamine
CID 80829928
2-N-ethyl-6-N-[(1-methylimidazol-2-yl)methyl]-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102718474

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine?
The IUPAC name of N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine (CID 79738561) is N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine?
The canonical SMILES for N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine is CCNc1nccnc1Cc1nccn1C.
What is the InChIKey of N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine?
The InChIKey is SUMQNBKXWMPODO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-3-12-11-9(13-4-5-15-11)8-10-14-6-7-16(10)2/h4-7H,3,8H2,1-2H3,(H,12,15).
What are the key properties of N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine?
N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine has a molecular weight of 217.28 g/mol, XLogP of 1.23, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 79738561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).