2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine

C10H18N4O — CID 62757423

IUPAC2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine
SMILESCOC1CCCC1NCc1cn(C)nn1
InChIInChI=1S/C10H18N4O/c1-14-7-8(12-13-14)6-11-9-4-3-5-10(9)15-2/h7,9-11H,3-6H2,1-2H3
InChIKeyZJUHKZQJBXZGAE-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.47
Rot. Bonds4

About 2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine

2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine (PubChem CID 62757423) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine
PubChem CID62757423
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine
SMILESCOC1CCCC1NCc1cn(C)nn1
InChIInChI=1S/C10H18N4O/c1-14-7-8(12-13-14)6-11-9-4-3-5-10(9)15-2/h7,9-11H,3-6H2,1-2H3
InChIKeyZJUHKZQJBXZGAE-UHFFFAOYSA-N
XLogP0.47
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine?
The IUPAC name of 2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine (CID 62757423) is 2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for 2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine is COC1CCCC1NCc1cn(C)nn1.
What is the InChIKey of 2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine?
The InChIKey is ZJUHKZQJBXZGAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-14-7-8(12-13-14)6-11-9-4-3-5-10(9)15-2/h7,9-11H,3-6H2,1-2H3.
What are the key properties of 2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine?
2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine has a molecular weight of 210.28 g/mol, XLogP of 0.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(1-methyltriazol-4-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 62757423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).