3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine

C14H21N5 — CID 154771003

IUPAC3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine
SMILESCc1cnc(C)c(NCCn2ccnc2C(C)C)n1
InChIInChI=1S/C14H21N5/c1-10(2)14-16-6-8-19(14)7-5-15-13-12(4)17-9-11(3)18-13/h6,8-10H,5,7H2,1-4H3,(H,15,18)
InChIKeySYQCMQUDWUFOSB-UHFFFAOYSA-N
MW259.36 g/mol
LogP2.53
Rot. Bonds5

About 3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine

3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine (PubChem CID 154771003) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine.

Molecular Properties

Compound Name3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine
PubChem CID154771003
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine
SMILESCc1cnc(C)c(NCCn2ccnc2C(C)C)n1
InChIInChI=1S/C14H21N5/c1-10(2)14-16-6-8-19(14)7-5-15-13-12(4)17-9-11(3)18-13/h6,8-10H,5,7H2,1-4H3,(H,15,18)
InChIKeySYQCMQUDWUFOSB-UHFFFAOYSA-N
XLogP2.53
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-N-[3-(2-propan-2-ylimidazol-1-yl)propyl]pyrido[3,2-d]pyrimidin-4-amine
CID 154568338
N-(4-chloropentyl)-3,6-dimethylpyrazin-2-amine
CID 106124735
N'-(3,6-dimethylpyrazin-2-yl)-N-methylethane-1,2-diamine
CID 62659686
N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]cyclohexanamine
CID 55087304
N-methyl-3-(2-propan-2-ylimidazol-1-yl)propan-1-amine
CID 61387413
N',N'-diethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]ethane-1,2-diamine
CID 62562672
3,6-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrazin-2-amine
CID 65416240
N-(4-imidazol-1-ylbutyl)-3,6-dimethylpyrazin-2-amine
CID 65416898
1-(2-fluoroethyl)-2-propan-2-ylimidazole
CID 80694983
3-methoxy-N-[3-(2-propan-2-ylimidazol-1-yl)propyl]pyrazin-2-amine
CID 134713687
4-methyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]cyclohexan-1-amine
CID 62563536
N-(cyclohexylmethyl)-2-(2-propan-2-ylimidazol-1-yl)ethanamine
CID 62562843

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine?
The IUPAC name of 3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine (CID 154771003) is 3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine.
What is the SMILES notation for 3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine?
The canonical SMILES for 3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine is Cc1cnc(C)c(NCCn2ccnc2C(C)C)n1.
What is the InChIKey of 3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine?
The InChIKey is SYQCMQUDWUFOSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-10(2)14-16-6-8-19(14)7-5-15-13-12(4)17-9-11(3)18-13/h6,8-10H,5,7H2,1-4H3,(H,15,18).
What are the key properties of 3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine?
3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine has a molecular weight of 259.36 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-N-[2-(2-propan-2-ylimidazol-1-yl)ethyl]pyrazin-2-amine is sourced from PubChem (CID 154771003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).