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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Related Compounds

1-(propan-2-ylamino)-3-(2,2,6-trimethylmorpholin-4-yl)cyclopentane-1-carboxamide
CID 79647708
4,4-difluoro-1-(propan-2-ylamino)cyclohexane-1-carboxamide
CID 164659290
3-(3,5-dimethylpiperidin-1-yl)-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79649924
3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79650663
3-[methyl(oxan-4-yl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79655558
3-[ethyl(methyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79654805
3,3-dimethyl-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 80706182
3-[methyl-(3-methylcyclohexyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79646644
3-(cyclopentylmethoxy)-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79653895
3-[methyl(propyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79650033
3-(4,5-dimethylimidazol-1-yl)-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79649025
3-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79653797

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).