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

C12H21N3O — CID 114527587

IUPAC2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
SMILESCOC1CCCC1NCCc1nccn1C
InChIInChI=1S/C12H21N3O/c1-15-9-8-14-12(15)6-7-13-10-4-3-5-11(10)16-2/h8-11,13H,3-7H2,1-2H3
InChIKeyCNXAFJFQAHBLHV-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.12
Rot. Bonds5

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

2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine (PubChem CID 114527587) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
PubChem CID114527587
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
SMILESCOC1CCCC1NCCc1nccn1C
InChIInChI=1S/C12H21N3O/c1-15-9-8-14-12(15)6-7-13-10-4-3-5-11(10)16-2/h8-11,13H,3-7H2,1-2H3
InChIKeyCNXAFJFQAHBLHV-UHFFFAOYSA-N
XLogP1.12
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine
CID 61214730
N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine
CID 61214993
N-[2-(1-methylimidazol-2-yl)ethyl]-1-azabicyclo[3.2.1]octan-4-amine
CID 105364456
2-[2-(1-methylimidazol-2-yl)ethyl]-N-propylcyclohexan-1-amine
CID 114528631
4-ethyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine
CID 61214727
1,2,5-trimethyl-N-[2-(1-methylimidazol-2-yl)ethyl]piperidin-4-amine
CID 61212215
3-chloro-N-[2-(1-methylimidazol-2-yl)ethyl]cyclobutan-1-amine
CID 114531771
N-[(1-methylimidazol-2-yl)methyl]cyclobutanamine
CID 62415731
N-[2-(1-methylimidazol-2-yl)ethyl]-1,1-dioxothian-3-amine
CID 63923427
N-ethyl-2-[(1-methylimidazol-2-yl)methyl]cyclopentan-1-amine
CID 79761914
3-ethyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
CID 64501340
2,3-dimethyl-N-[(1-methylimidazol-2-yl)methyl]cyclohexan-1-amine
CID 43088207

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine?
The IUPAC name of 2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine (CID 114527587) is 2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine is COC1CCCC1NCCc1nccn1C.
What is the InChIKey of 2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine?
The InChIKey is CNXAFJFQAHBLHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-15-9-8-14-12(15)6-7-13-10-4-3-5-11(10)16-2/h8-11,13H,3-7H2,1-2H3.
What are the key properties of 2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine?
2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine has a molecular weight of 223.32 g/mol, XLogP of 1.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 114527587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).