(5-cyclohexyl-3-methyltriazol-4-yl)methanamine

C10H18N4 — CID 105448581

IUPAC(5-cyclohexyl-3-methyltriazol-4-yl)methanamine
SMILESCn1nnc(C2CCCCC2)c1CN
InChIInChI=1S/C10H18N4/c1-14-9(7-11)10(12-13-14)8-5-3-2-4-6-8/h8H,2-7,11H2,1H3
InChIKeyOZGUDRULTKTEPC-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.32
Rot. Bonds2

About (5-cyclohexyl-3-methyltriazol-4-yl)methanamine

(5-cyclohexyl-3-methyltriazol-4-yl)methanamine (PubChem CID 105448581) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is (5-cyclohexyl-3-methyltriazol-4-yl)methanamine.

Molecular Properties

Compound Name(5-cyclohexyl-3-methyltriazol-4-yl)methanamine
PubChem CID105448581
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name(5-cyclohexyl-3-methyltriazol-4-yl)methanamine
SMILESCn1nnc(C2CCCCC2)c1CN
InChIInChI=1S/C10H18N4/c1-14-9(7-11)10(12-13-14)8-5-3-2-4-6-8/h8H,2-7,11H2,1H3
InChIKeyOZGUDRULTKTEPC-UHFFFAOYSA-N
XLogP1.32
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(5-cycloheptyl-3-methyltriazol-4-yl)methanamine
CID 105462408
(3-cyclobutyl-5-cyclopentyltriazol-4-yl)methanamine
CID 105476755
5-cycloheptyl-3-methyltriazole-4-carbaldehyde
CID 105460836
5-cyclohexyl-1-methyltriazol-4-amine
CID 105439082
5-cyclohexyl-3-propan-2-yltriazol-4-amine
CID 105462405
2-(5-cyclobutyl-1-methyltriazol-4-yl)ethanamine
CID 164663726
5-cyclooctyl-2,4-dimethylpyrazol-3-amine
CID 65018283
4-[5-(aminomethyl)-4-cyclopropyltriazol-1-yl]phenol
CID 105488090
5-cyclopentyl-3-propan-2-yltriazol-4-amine
CID 105448577
5-cyclooctyl-2-methyl-4-propylpyrazol-3-amine
CID 79406049
5-(aminomethyl)-2-cyclohexyl-4-methylpyridin-3-amine
CID 151137406
(5-cyclohexyl-1-hexyltriazol-4-yl)methanamine
CID 82206090

Frequently Asked Questions

What is the IUPAC name of (5-cyclohexyl-3-methyltriazol-4-yl)methanamine?
The IUPAC name of (5-cyclohexyl-3-methyltriazol-4-yl)methanamine (CID 105448581) is (5-cyclohexyl-3-methyltriazol-4-yl)methanamine.
What is the SMILES notation for (5-cyclohexyl-3-methyltriazol-4-yl)methanamine?
The canonical SMILES for (5-cyclohexyl-3-methyltriazol-4-yl)methanamine is Cn1nnc(C2CCCCC2)c1CN.
What is the InChIKey of (5-cyclohexyl-3-methyltriazol-4-yl)methanamine?
The InChIKey is OZGUDRULTKTEPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-14-9(7-11)10(12-13-14)8-5-3-2-4-6-8/h8H,2-7,11H2,1H3.
What are the key properties of (5-cyclohexyl-3-methyltriazol-4-yl)methanamine?
(5-cyclohexyl-3-methyltriazol-4-yl)methanamine has a molecular weight of 194.28 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclohexyl-3-methyltriazol-4-yl)methanamine is sourced from PubChem (CID 105448581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).