N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine

C17H29N3O — CID 114342320

IUPACN-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC1(C)CCC(Oc2cncc(CNC(C)(C)C)n2)CC1
InChIInChI=1S/C17H29N3O/c1-16(2,3)19-11-13-10-18-12-15(20-13)21-14-6-8-17(4,5)9-7-14/h10,12,14,19H,6-9,11H2,1-5H3
InChIKeyQDMOFQUYVCPUBA-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.71
Rot. Bonds4

About N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine

N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 114342320) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID114342320
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC NameN-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC1(C)CCC(Oc2cncc(CNC(C)(C)C)n2)CC1
InChIInChI=1S/C17H29N3O/c1-16(2,3)19-11-13-10-18-12-15(20-13)21-14-6-8-17(4,5)9-7-14/h10,12,14,19H,6-9,11H2,1-5H3
InChIKeyQDMOFQUYVCPUBA-UHFFFAOYSA-N
XLogP3.71
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine with MolForge

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Related Compounds

N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 114342313
N-[[6-(3,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 66465906
N-[[6-(3-ethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 66467051
N-[(6-but-3-enoxypyrazin-2-yl)methyl]-2-methylpropan-2-amine
CID 66451941
N-[(6-cyclopentyloxy-2-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62289891
1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine
CID 79678942
2-methyl-N-[[6-(oxan-2-ylmethoxy)pyrazin-2-yl]methyl]propan-2-amine
CID 66449796
2-methyl-N-[[6-[(6-methylcyclohex-3-en-1-yl)methoxy]pyrazin-2-yl]methyl]propan-2-amine
CID 66450992
2-methyl-N-[(6-phenylmethoxypyrazin-2-yl)methyl]propan-2-amine
CID 66451944
(6-cyclobutyloxypyrazin-2-yl)methanamine
CID 66450566
N-[[4-[(4,4-dimethylcyclohexyl)oxymethyl]-1,3-thiazol-2-yl]methyl]-2-methylpropan-2-amine
CID 114342496
2-methyl-N-[[5-(1-methylpiperidin-4-yl)oxypyrazin-2-yl]methyl]propan-2-amine
CID 107381292

Frequently Asked Questions

What is the IUPAC name of N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine (CID 114342320) is N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine is CC1(C)CCC(Oc2cncc(CNC(C)(C)C)n2)CC1.
What is the InChIKey of N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is QDMOFQUYVCPUBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-16(2,3)19-11-13-10-18-12-15(20-13)21-14-6-8-17(4,5)9-7-14/h10,12,14,19H,6-9,11H2,1-5H3.
What are the key properties of N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine?
N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 291.44 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 114342320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).