(3-ethylimidazol-4-yl)-piperazin-1-ylmethanone

C10H16N4O — CID 83883937

IUPAC(3-ethylimidazol-4-yl)-piperazin-1-ylmethanone
SMILESCCn1cncc1C(=O)N1CCNCC1
InChIInChI=1S/C10H16N4O/c1-2-13-8-12-7-9(13)10(15)14-5-3-11-4-6-14/h7-8,11H,2-6H2,1H3
InChIKeyHJOFGVWJSWITET-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.05
Rot. Bonds2

About (3-ethylimidazol-4-yl)-piperazin-1-ylmethanone

(3-ethylimidazol-4-yl)-piperazin-1-ylmethanone (PubChem CID 83883937) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is (3-ethylimidazol-4-yl)-piperazin-1-ylmethanone.

Molecular Properties

Compound Name(3-ethylimidazol-4-yl)-piperazin-1-ylmethanone
PubChem CID83883937
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name(3-ethylimidazol-4-yl)-piperazin-1-ylmethanone
SMILESCCn1cncc1C(=O)N1CCNCC1
InChIInChI=1S/C10H16N4O/c1-2-13-8-12-7-9(13)10(15)14-5-3-11-4-6-14/h7-8,11H,2-6H2,1H3
InChIKeyHJOFGVWJSWITET-UHFFFAOYSA-N
XLogP-0.05
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,4-diazepan-1-yl-(3-methylimidazol-4-yl)methanone
CID 83883938
(1-ethyl-4-nitropyrrol-2-yl)-piperazin-1-ylmethanone
CID 43639663
piperazin-1-yl-(1-propylpyrrol-2-yl)methanone
CID 43639000
(1-ethylpyrazol-4-yl)-piperazin-1-ylmethanone
CID 83883921
(3-methylimidazol-4-yl)-(3-piperazin-1-ylazetidin-1-yl)methanone
CID 103511608
(1-ethyl-3-methylpyrazol-4-yl)-piperazin-1-ylmethanone
CID 82509456
(2,5-dimethylpyrazol-3-yl)-piperazin-1-ylmethanone;hydrochloride
CID 119402592
2-(1,4-diazepan-1-yl)-2-(3-ethylimidazol-4-yl)ethanol
CID 66134960
3,4-dihydro-1H-isoquinolin-2-yl-[(2S)-4-(3-ethylimidazole-4-carbonyl)morpholin-2-yl]methanone
CID 92635376
5-[(E)-but-2-en-2-yl]-1-ethylimidazole
CID 144852857
4-(3-ethylimidazole-4-carbonyl)benzonitrile
CID 71711430
(1,5-dimethylpyrrol-2-yl)-piperazin-1-ylmethanone
CID 28788625

Frequently Asked Questions

What is the IUPAC name of (3-ethylimidazol-4-yl)-piperazin-1-ylmethanone?
The IUPAC name of (3-ethylimidazol-4-yl)-piperazin-1-ylmethanone (CID 83883937) is (3-ethylimidazol-4-yl)-piperazin-1-ylmethanone.
What is the SMILES notation for (3-ethylimidazol-4-yl)-piperazin-1-ylmethanone?
The canonical SMILES for (3-ethylimidazol-4-yl)-piperazin-1-ylmethanone is CCn1cncc1C(=O)N1CCNCC1.
What is the InChIKey of (3-ethylimidazol-4-yl)-piperazin-1-ylmethanone?
The InChIKey is HJOFGVWJSWITET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-2-13-8-12-7-9(13)10(15)14-5-3-11-4-6-14/h7-8,11H,2-6H2,1H3.
What are the key properties of (3-ethylimidazol-4-yl)-piperazin-1-ylmethanone?
(3-ethylimidazol-4-yl)-piperazin-1-ylmethanone has a molecular weight of 208.26 g/mol, XLogP of -0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylimidazol-4-yl)-piperazin-1-ylmethanone is sourced from PubChem (CID 83883937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).