6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine

C16H28N4 — CID 79848489

IUPAC6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine
SMILESCNC1C(CN2CCn3ccnc3C2)CCCC1(C)C
InChIInChI=1S/C16H28N4/c1-16(2)6-4-5-13(15(16)17-3)11-19-9-10-20-8-7-18-14(20)12-19/h7-8,13,15,17H,4-6,9-12H2,1-3H3
InChIKeyPOIXHWHFBIJTRQ-UHFFFAOYSA-N
MW276.43 g/mol
LogP2.11
Rot. Bonds3

About 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine

6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine (PubChem CID 79848489) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine.

Molecular Properties

Compound Name6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine
PubChem CID79848489
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC Name6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine
SMILESCNC1C(CN2CCn3ccnc3C2)CCCC1(C)C
InChIInChI=1S/C16H28N4/c1-16(2)6-4-5-13(15(16)17-3)11-19-9-10-20-8-7-18-14(20)12-19/h7-8,13,15,17H,4-6,9-12H2,1-3H3
InChIKeyPOIXHWHFBIJTRQ-UHFFFAOYSA-N
XLogP2.11
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine?
The IUPAC name of 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine (CID 79848489) is 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine.
What is the SMILES notation for 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine?
The canonical SMILES for 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine is CNC1C(CN2CCn3ccnc3C2)CCCC1(C)C.
What is the InChIKey of 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine?
The InChIKey is POIXHWHFBIJTRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-16(2)6-4-5-13(15(16)17-3)11-19-9-10-20-8-7-18-14(20)12-19/h7-8,13,15,17H,4-6,9-12H2,1-3H3.
What are the key properties of 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine?
6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine has a molecular weight of 276.43 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N,2,2-trimethylcyclohexan-1-amine is sourced from PubChem (CID 79848489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).