[5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol

C13H21N3O — CID 107372760

IUPAC[5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol
SMILESCC1CCC(N(C)c2cnc(CO)cn2)CC1
InChIInChI=1S/C13H21N3O/c1-10-3-5-12(6-4-10)16(2)13-8-14-11(9-17)7-15-13/h7-8,10,12,17H,3-6,9H2,1-2H3
InChIKeyZBTXPRWXDZYOSE-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.98
Rot. Bonds3

About [5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol

[5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol (PubChem CID 107372760) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is [5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol.

Molecular Properties

Compound Name[5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol
PubChem CID107372760
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name[5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol
SMILESCC1CCC(N(C)c2cnc(CO)cn2)CC1
InChIInChI=1S/C13H21N3O/c1-10-3-5-12(6-4-10)16(2)13-8-14-11(9-17)7-15-13/h7-8,10,12,17H,3-6,9H2,1-2H3
InChIKeyZBTXPRWXDZYOSE-UHFFFAOYSA-N
XLogP1.98
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[methyl-(4-methylcyclohexyl)amino]-2-pyridinyl]methanol
CID 61437354
5-chloro-N-methyl-N-(4-methylcyclohexyl)pyridin-2-amine
CID 66232762
N-cyclopentyl-N-methyl-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379057
5-(aminomethyl)-N-(4,4-difluorocyclohexyl)-N-methylpyrazin-2-amine
CID 174276108
[5-[cyclopropyl(2,2,2-trifluoroethyl)amino]pyrazin-2-yl]methanol
CID 107372801
[5-[cyclopropyl(prop-2-enyl)amino]pyrazin-2-yl]methanol
CID 107372934
[5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol
CID 107372763
6-[methyl-(4-methylcyclohexyl)amino]pyridine-3-carbonitrile
CID 60706429
[5-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]pyrazin-2-yl]methanol
CID 107372861
2-[[5-(hydroxymethyl)pyrazin-2-yl]-methylamino]ethanol
CID 107372728
[5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol
CID 107372967
[6-[cyclohexyl(methyl)amino]pyrazin-2-yl]methanol
CID 66467743

Frequently Asked Questions

What is the IUPAC name of [5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol?
The IUPAC name of [5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol (CID 107372760) is [5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol.
What is the SMILES notation for [5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol?
The canonical SMILES for [5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol is CC1CCC(N(C)c2cnc(CO)cn2)CC1.
What is the InChIKey of [5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol?
The InChIKey is ZBTXPRWXDZYOSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-10-3-5-12(6-4-10)16(2)13-8-14-11(9-17)7-15-13/h7-8,10,12,17H,3-6,9H2,1-2H3.
What are the key properties of [5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol?
[5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol has a molecular weight of 235.33 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol is sourced from PubChem (CID 107372760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).