5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine

C9H14ClN3 — CID 117260383

IUPAC5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine
SMILESCCn1c(Cl)cnc1NC1CCC1
InChIInChI=1S/C9H14ClN3/c1-2-13-8(10)6-11-9(13)12-7-4-3-5-7/h6-7H,2-5H2,1H3,(H,11,12)
InChIKeyNHGWFFUAFZNOMZ-UHFFFAOYSA-N
MW199.68 g/mol
LogP2.52
Rot. Bonds3

About 5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine

5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine (PubChem CID 117260383) has the molecular formula C9H14ClN3 and a molecular weight of 199.68 g/mol. Its IUPAC name is 5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine.

Molecular Properties

Compound Name5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine
PubChem CID117260383
Molecular FormulaC9H14ClN3
Molecular Weight199.68 g/mol
Exact Mass199.09
IUPAC Name5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine
SMILESCCn1c(Cl)cnc1NC1CCC1
InChIInChI=1S/C9H14ClN3/c1-2-13-8(10)6-11-9(13)12-7-4-3-5-7/h6-7H,2-5H2,1H3,(H,11,12)
InChIKeyNHGWFFUAFZNOMZ-UHFFFAOYSA-N
XLogP2.52
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.68
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-cyclopentyl-3-ethylimidazole-2,4-diamine
CID 117190557
5-chloro-1-ethylimidazol-2-amine
CID 117260387
5-chloro-1-ethyl-2-(4-methylphenyl)imidazole
CID 117259483
5-(aminomethyl)-N-cyclopropyl-4-ethyl-1,2,4-triazol-3-amine
CID 83875837
2-chloro-5-cyclohexyl-1-ethylimidazole
CID 117260188
2-(cyclopentylamino)-3-ethyl-7-methylthieno[3,2-d]pyrimidin-4-one
CID 118719994
N-(1-ethylpiperidin-4-yl)-5-methylpyrimidin-2-amine
CID 63208182
N-cycloheptyl-1-ethylpyrazol-4-amine
CID 43543541
1-ethyl-N-(3-ethylcyclohexyl)imidazol-2-amine
CID 64742243
4-(cyclobutylamino)-1-ethylpyrazolo[3,4-b]pyridine-5-carbaldehyde
CID 123229552
6-chloro-N-cyclobutylpyridin-3-amine
CID 75525310
4-(5-chloro-1-methylimidazol-2-yl)-1-ethylpiperidine
CID 117259171

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine?
The IUPAC name of 5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine (CID 117260383) is 5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine.
What is the SMILES notation for 5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine?
The canonical SMILES for 5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine is CCn1c(Cl)cnc1NC1CCC1.
What is the InChIKey of 5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine?
The InChIKey is NHGWFFUAFZNOMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14ClN3/c1-2-13-8(10)6-11-9(13)12-7-4-3-5-7/h6-7H,2-5H2,1H3,(H,11,12).
What are the key properties of 5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine?
5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine has a molecular weight of 199.68 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclobutyl-1-ethylimidazol-2-amine is sourced from PubChem (CID 117260383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).