(4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine

C13H21N3 — CID 105153825

IUPAC(4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine
SMILESCc1cnc(C(N)C2CCC(C)CC2)cn1
InChIInChI=1S/C13H21N3/c1-9-3-5-11(6-4-9)13(14)12-8-15-10(2)7-16-12/h7-9,11,13H,3-6,14H2,1-2H3
InChIKeyRYRJMGMESWGXMC-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.61
Rot. Bonds2

About (4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine

(4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine (PubChem CID 105153825) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is (4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine.

Molecular Properties

Compound Name(4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine
PubChem CID105153825
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name(4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine
SMILESCc1cnc(C(N)C2CCC(C)CC2)cn1
InChIInChI=1S/C13H21N3/c1-9-3-5-11(6-4-9)13(14)12-8-15-10(2)7-16-12/h7-9,11,13H,3-6,14H2,1-2H3
InChIKeyRYRJMGMESWGXMC-UHFFFAOYSA-N
XLogP2.61
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methylcyclohexyl)-pyrazin-2-ylmethanamine
CID 63967981
(4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine
CID 64775459
cyclopropyl-(5-methyl-2-pyridinyl)methanamine;hydrochloride
CID 171338154
2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine
CID 105139032
(3,5-dimethylphenyl)-(4-methylcyclohexyl)methanamine
CID 63415986
2,2-dimethyl-1-(5-methylpyrazin-2-yl)propan-1-amine
CID 105146061
(R)-(4-methylcyclohexyl)-pyridin-4-ylmethanamine
CID 96735910
(4-methylcyclohexyl)-(3-methyltriazol-4-yl)methanamine
CID 114687447
(R)-(5-bromo-2-pyridinyl)-cyclopropylmethanamine;hydrochloride
CID 171203241
(4-methylcyclohexyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine
CID 106783141
(6-methyl-3-pyridinyl)-(4-propylcyclohexyl)methanamine
CID 65424529
(3-methylcyclopentyl)-(1,3-thiazol-4-yl)methanamine
CID 126987199

Frequently Asked Questions

What is the IUPAC name of (4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine?
The IUPAC name of (4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine (CID 105153825) is (4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine.
What is the SMILES notation for (4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine?
The canonical SMILES for (4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine is Cc1cnc(C(N)C2CCC(C)CC2)cn1.
What is the InChIKey of (4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine?
The InChIKey is RYRJMGMESWGXMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-9-3-5-11(6-4-9)13(14)12-8-15-10(2)7-16-12/h7-9,11,13H,3-6,14H2,1-2H3.
What are the key properties of (4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine?
(4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine has a molecular weight of 219.33 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylcyclohexyl)-(5-methylpyrazin-2-yl)methanamine is sourced from PubChem (CID 105153825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).