6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide

C10H20N2O2 — CID 164655659

IUPAC6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide
SMILESCC(C)NC1(C(N)=O)CCC(C)OC1
InChIInChI=1S/C10H20N2O2/c1-7(2)12-10(9(11)13)5-4-8(3)14-6-10/h7-8,12H,4-6H2,1-3H3,(H2,11,13)
InChIKeyXJCIBUDRQUZAQI-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.41
Rot. Bonds3

About 6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide

6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide (PubChem CID 164655659) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide.

Molecular Properties

Compound Name6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide
PubChem CID164655659
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide
SMILESCC(C)NC1(C(N)=O)CCC(C)OC1
InChIInChI=1S/C10H20N2O2/c1-7(2)12-10(9(11)13)5-4-8(3)14-6-10/h7-8,12H,4-6H2,1-3H3,(H2,11,13)
InChIKeyXJCIBUDRQUZAQI-UHFFFAOYSA-N
XLogP0.41
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide?
The IUPAC name of 6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide (CID 164655659) is 6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide.
What is the SMILES notation for 6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide?
The canonical SMILES for 6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide is CC(C)NC1(C(N)=O)CCC(C)OC1.
What is the InChIKey of 6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide?
The InChIKey is XJCIBUDRQUZAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(2)12-10(9(11)13)5-4-8(3)14-6-10/h7-8,12H,4-6H2,1-3H3,(H2,11,13).
What are the key properties of 6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide?
6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-(propan-2-ylamino)oxane-3-carboxamide is sourced from PubChem (CID 164655659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).