5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine

C11H18N2O — CID 66198258

IUPAC5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine
SMILESCC(C)Cc1c(N)noc1C1CC1C
InChIInChI=1S/C11H18N2O/c1-6(2)4-9-10(8-5-7(8)3)14-13-11(9)12/h6-8H,4-5H2,1-3H3,(H2,12,13)
InChIKeyJWEOTIUHQJCQNS-UHFFFAOYSA-N
MW194.28 g/mol
LogP2.58
Rot. Bonds3

About 5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine

5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine (PubChem CID 66198258) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine
PubChem CID66198258
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine
SMILESCC(C)Cc1c(N)noc1C1CC1C
InChIInChI=1S/C11H18N2O/c1-6(2)4-9-10(8-5-7(8)3)14-13-11(9)12/h6-8H,4-5H2,1-3H3,(H2,12,13)
InChIKeyJWEOTIUHQJCQNS-UHFFFAOYSA-N
XLogP2.58
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine?
The IUPAC name of 5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine (CID 66198258) is 5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine?
The canonical SMILES for 5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine is CC(C)Cc1c(N)noc1C1CC1C.
What is the InChIKey of 5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine?
The InChIKey is JWEOTIUHQJCQNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-6(2)4-9-10(8-5-7(8)3)14-13-11(9)12/h6-8H,4-5H2,1-3H3,(H2,12,13).
What are the key properties of 5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine?
5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine has a molecular weight of 194.28 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylcyclopropyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 66198258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).