1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine

C10H15ClN2O — CID 105468182

IUPAC1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine
SMILESCCc1noc(Cl)c1CCC1(N)CC1
InChIInChI=1S/C10H15ClN2O/c1-2-8-7(9(11)14-13-8)3-4-10(12)5-6-10/h2-6,12H2,1H3
InChIKeyFUTDNLRPYXBHNW-UHFFFAOYSA-N
MW214.70 g/mol
LogP2.31
Rot. Bonds4

About 1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine

1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine (PubChem CID 105468182) has the molecular formula C10H15ClN2O and a molecular weight of 214.70 g/mol. Its IUPAC name is 1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine
PubChem CID105468182
Molecular FormulaC10H15ClN2O
Molecular Weight214.70 g/mol
Exact Mass214.09
IUPAC Name1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine
SMILESCCc1noc(Cl)c1CCC1(N)CC1
InChIInChI=1S/C10H15ClN2O/c1-2-8-7(9(11)14-13-8)3-4-10(12)5-6-10/h2-6,12H2,1H3
InChIKeyFUTDNLRPYXBHNW-UHFFFAOYSA-N
XLogP2.31
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.70
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine (CID 105468182) is 1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine is CCc1noc(Cl)c1CCC1(N)CC1.
What is the InChIKey of 1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine?
The InChIKey is FUTDNLRPYXBHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O/c1-2-8-7(9(11)14-13-8)3-4-10(12)5-6-10/h2-6,12H2,1H3.
What are the key properties of 1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine?
1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine has a molecular weight of 214.70 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-chloro-3-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 105468182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).