[2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine

C13H23N3O — CID 106938478

IUPAC[2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine
SMILESCCn1ccnc1COCC1CCCC1CN
InChIInChI=1S/C13H23N3O/c1-2-16-7-6-15-13(16)10-17-9-12-5-3-4-11(12)8-14/h6-7,11-12H,2-5,8-10,14H2,1H3
InChIKeyHFJMJSLLALBBIH-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.79
Rot. Bonds6

About [2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine

[2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine (PubChem CID 106938478) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is [2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine.

Molecular Properties

Compound Name[2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine
PubChem CID106938478
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name[2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine
SMILESCCn1ccnc1COCC1CCCC1CN
InChIInChI=1S/C13H23N3O/c1-2-16-7-6-15-13(16)10-17-9-12-5-3-4-11(12)8-14/h6-7,11-12H,2-5,8-10,14H2,1H3
InChIKeyHFJMJSLLALBBIH-UHFFFAOYSA-N
XLogP1.79
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[[1-(difluoromethyl)imidazol-2-yl]methoxymethyl]cyclohexyl]methanamine
CID 106938434
[2-[2-(1-methylimidazol-2-yl)ethoxymethyl]cyclopentyl]methanamine
CID 114528585
1-[2-(aminomethyl)cyclopentyl]-2-(1-ethylimidazol-2-yl)ethanone
CID 116584210
[2-[(1-ethylimidazol-2-yl)methyl]-4-methylcyclohexyl]methanamine
CID 81010089
[2-[(3-methyl-2-pyridinyl)methoxymethyl]cyclohexyl]methanamine
CID 112650781
3-[(1-ethylimidazol-2-yl)methoxymethyl]pentan-3-amine
CID 106938283
2-[(1-ethylimidazol-2-yl)methyl]cyclobutan-1-amine
CID 81014583
N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine
CID 83229115
N-[[2-[(1-ethylimidazol-2-yl)methyl]cyclopentyl]methyl]cyclopropanamine
CID 81033575
[2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethoxymethyl)cyclohexyl]methanamine
CID 107078207
3-[(1-ethylimidazol-2-yl)methyl]-2-methylcyclopentan-1-amine
CID 79762054
1-cyclobutyl-2-(1-ethylimidazol-2-yl)ethanone
CID 79744561

Frequently Asked Questions

What is the IUPAC name of [2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine?
The IUPAC name of [2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine (CID 106938478) is [2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine.
What is the SMILES notation for [2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine?
The canonical SMILES for [2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine is CCn1ccnc1COCC1CCCC1CN.
What is the InChIKey of [2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine?
The InChIKey is HFJMJSLLALBBIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-2-16-7-6-15-13(16)10-17-9-12-5-3-4-11(12)8-14/h6-7,11-12H,2-5,8-10,14H2,1H3.
What are the key properties of [2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine?
[2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine has a molecular weight of 237.35 g/mol, XLogP of 1.79, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(1-ethylimidazol-2-yl)methoxymethyl]cyclopentyl]methanamine is sourced from PubChem (CID 106938478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).