2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine

C10H18N2O — CID 155042171

IUPAC2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine
SMILESCc1oc(C(C)C)nc1C(C)(C)N
InChIInChI=1S/C10H18N2O/c1-6(2)9-12-8(7(3)13-9)10(4,5)11/h6H,11H2,1-5H3
InChIKeyCQFWKSJPKFNXAP-UHFFFAOYSA-N
MW182.27 g/mol
LogP2.30
Rot. Bonds2

About 2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine

2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine (PubChem CID 155042171) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine.

Molecular Properties

Compound Name2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine
PubChem CID155042171
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine
SMILESCc1oc(C(C)C)nc1C(C)(C)N
InChIInChI=1S/C10H18N2O/c1-6(2)9-12-8(7(3)13-9)10(4,5)11/h6H,11H2,1-5H3
InChIKeyCQFWKSJPKFNXAP-UHFFFAOYSA-N
XLogP2.30
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine?
The IUPAC name of 2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine (CID 155042171) is 2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine.
What is the SMILES notation for 2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine?
The canonical SMILES for 2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine is Cc1oc(C(C)C)nc1C(C)(C)N.
What is the InChIKey of 2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine?
The InChIKey is CQFWKSJPKFNXAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-6(2)9-12-8(7(3)13-9)10(4,5)11/h6H,11H2,1-5H3.
What are the key properties of 2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine?
2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine has a molecular weight of 182.27 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2-propan-2-yl-1,3-oxazol-4-yl)propan-2-amine is sourced from PubChem (CID 155042171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).