3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine

C10H17N3O — CID 106938655

IUPAC3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine
SMILESCn1ccnc1COC1CCC(N)C1
InChIInChI=1S/C10H17N3O/c1-13-5-4-12-10(13)7-14-9-3-2-8(11)6-9/h4-5,8-9H,2-3,6-7,11H2,1H3
InChIKeyGTXOIXAEZDMVEJ-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.82
Rot. Bonds3

About 3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine

3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine (PubChem CID 106938655) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine.

Molecular Properties

Compound Name3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine
PubChem CID106938655
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine
SMILESCn1ccnc1COC1CCC(N)C1
InChIInChI=1S/C10H17N3O/c1-13-5-4-12-10(13)7-14-9-3-2-8(11)6-9/h4-5,8-9H,2-3,6-7,11H2,1H3
InChIKeyGTXOIXAEZDMVEJ-UHFFFAOYSA-N
XLogP0.82
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine?
The IUPAC name of 3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine (CID 106938655) is 3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine.
What is the SMILES notation for 3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine?
The canonical SMILES for 3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine is Cn1ccnc1COC1CCC(N)C1.
What is the InChIKey of 3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine?
The InChIKey is GTXOIXAEZDMVEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13-5-4-12-10(13)7-14-9-3-2-8(11)6-9/h4-5,8-9H,2-3,6-7,11H2,1H3.
What are the key properties of 3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine?
3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine has a molecular weight of 195.27 g/mol, XLogP of 0.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-methylimidazol-2-yl)methoxy]cyclopentan-1-amine is sourced from PubChem (CID 106938655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).