4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine

C10H18N4O — CID 107041689

IUPAC4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine
SMILESCn1cc(COC2CCC(N)CC2)nn1
InChIInChI=1S/C10H18N4O/c1-14-6-9(12-13-14)7-15-10-4-2-8(11)3-5-10/h6,8,10H,2-5,7,11H2,1H3
InChIKeyUILLTJMDXSXOFW-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.60
Rot. Bonds3

About 4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine

4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine (PubChem CID 107041689) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine
PubChem CID107041689
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine
SMILESCn1cc(COC2CCC(N)CC2)nn1
InChIInChI=1S/C10H18N4O/c1-14-6-9(12-13-14)7-15-10-4-2-8(11)3-5-10/h6,8,10H,2-5,7,11H2,1H3
InChIKeyUILLTJMDXSXOFW-UHFFFAOYSA-N
XLogP0.60
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(1-methyltriazol-4-yl)methoxy]cyclobutan-1-amine
CID 107044452
[3-[(1-methyltriazol-4-yl)methoxy]cyclobutyl]methanamine
CID 107044450
(2S,4R)-4-[(1-methyltriazol-4-yl)methoxy]pyrrolidine-2-carboxylic acid
CID 59188307
(1-methyltriazol-4-yl)methyl acetate
CID 89224817
(1-methyltriazol-4-yl)methyl 4-amino-1-cyclopropylpyrrole-2-carboxylate
CID 107052158
4-(1-methyltriazol-4-yl)butan-2-amine
CID 107044565
4-(1-methoxyethoxymethyl)-1-methyltriazole
CID 174763188
[4-tert-butyl-1-[(1-methyltriazol-4-yl)methoxy]cyclohexyl]methanamine
CID 107040805
4-(2-(18F)fluoroethoxymethyl)-1-methyltriazole
CID 87414714
1-[5-[(1-methyltriazol-4-yl)methoxy]-3-pyridinyl]piperidin-3-amine
CID 107052299
1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine
CID 107051012
(3S)-3-[4-[(4-aminocyclohexyl)oxymethyl]triazol-1-yl]-4,4-dimethylpentan-2-one;(2S,4S)-4-hydroxy-N,2-dimethylhexanamide;methane
CID 163387017

Frequently Asked Questions

What is the IUPAC name of 4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine?
The IUPAC name of 4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine (CID 107041689) is 4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine.
What is the SMILES notation for 4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine?
The canonical SMILES for 4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine is Cn1cc(COC2CCC(N)CC2)nn1.
What is the InChIKey of 4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine?
The InChIKey is UILLTJMDXSXOFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-14-6-9(12-13-14)7-15-10-4-2-8(11)3-5-10/h6,8,10H,2-5,7,11H2,1H3.
What are the key properties of 4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine?
4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine has a molecular weight of 210.28 g/mol, XLogP of 0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-methyltriazol-4-yl)methoxy]cyclohexan-1-amine is sourced from PubChem (CID 107041689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).