(1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone

C12H18N2O2 — CID 104610250

IUPAC(1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone
SMILESCCn1ccnc1C(=O)C1(OC)CCCC1
InChIInChI=1S/C12H18N2O2/c1-3-14-9-8-13-11(14)10(15)12(16-2)6-4-5-7-12/h8-9H,3-7H2,1-2H3
InChIKeyOQCBKIKZDVPQPD-UHFFFAOYSA-N
MW222.29 g/mol
LogP2.04
Rot. Bonds4

About (1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone

(1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone (PubChem CID 104610250) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is (1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone.

Molecular Properties

Compound Name(1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone
PubChem CID104610250
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name(1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone
SMILESCCn1ccnc1C(=O)C1(OC)CCCC1
InChIInChI=1S/C12H18N2O2/c1-3-14-9-8-13-11(14)10(15)12(16-2)6-4-5-7-12/h8-9H,3-7H2,1-2H3
InChIKeyOQCBKIKZDVPQPD-UHFFFAOYSA-N
XLogP2.04
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(1-methoxycyclobutyl)-(1-propylimidazol-2-yl)methanone
CID 116706985
(1-ethylcyclopentyl)-(1-ethylimidazol-2-yl)methanone
CID 114973020
(1-methoxycyclopentyl)-(1-methylimidazol-2-yl)methanone
CID 104610183
(1-methoxycycloheptyl)-(1-methylimidazol-2-yl)methanone
CID 116750447
(1-ethoxy-4,4-dimethylcyclohexyl)-(1-ethylimidazol-2-yl)methanone
CID 116750075
(1-ethylimidazol-2-yl)-(2-methyloxan-2-yl)methanone
CID 80683731
2-(1-ethylimidazol-2-yl)-1-(1-methoxycyclobutyl)ethanone
CID 116707035
(1-ethylimidazol-2-yl)-(2-methylthiolan-2-yl)methanone
CID 105101153
2-(1-aminocyclohexyl)-1-(1-ethylimidazol-2-yl)ethanone
CID 116579048
(1-ethylimidazol-2-yl)-(2-ethylpyrrolidin-2-yl)methanone
CID 116608218
(2,2-dimethylcyclohexyl)-(1-ethylimidazol-2-yl)methanone
CID 107186966
(2-ethylpyrazol-3-yl)-(1-methoxycycloheptyl)methanone
CID 116750647

Frequently Asked Questions

What is the IUPAC name of (1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone?
The IUPAC name of (1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone (CID 104610250) is (1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone.
What is the SMILES notation for (1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone?
The canonical SMILES for (1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone is CCn1ccnc1C(=O)C1(OC)CCCC1.
What is the InChIKey of (1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone?
The InChIKey is OQCBKIKZDVPQPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-3-14-9-8-13-11(14)10(15)12(16-2)6-4-5-7-12/h8-9H,3-7H2,1-2H3.
What are the key properties of (1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone?
(1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone has a molecular weight of 222.29 g/mol, XLogP of 2.04, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylimidazol-2-yl)-(1-methoxycyclopentyl)methanone is sourced from PubChem (CID 104610250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).