2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine

C16H29N3O — CID 103503049

IUPAC2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
SMILESCC(C)C1CCN(c2nc(CNC(C)(C)C)co2)CC1
InChIInChI=1S/C16H29N3O/c1-12(2)13-6-8-19(9-7-13)15-18-14(11-20-15)10-17-16(3,4)5/h11-13,17H,6-10H2,1-5H3
InChIKeyZBJKMUYXSKNGNA-UHFFFAOYSA-N
MW279.43 g/mol
LogP3.44
Rot. Bonds4

About 2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine

2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine (PubChem CID 103503049) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is 2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
PubChem CID103503049
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC Name2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
SMILESCC(C)C1CCN(c2nc(CNC(C)(C)C)co2)CC1
InChIInChI=1S/C16H29N3O/c1-12(2)13-6-8-19(9-7-13)15-18-14(11-20-15)10-17-16(3,4)5/h11-13,17H,6-10H2,1-5H3
InChIKeyZBJKMUYXSKNGNA-UHFFFAOYSA-N
XLogP3.44
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine with MolForge

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Related Compounds

N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methanamine
CID 103503007
N-[[2-(4-ethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]cyclopropanamine
CID 113377755
N-methyl-1-[2-(4-methylsulfanylazepan-1-yl)-1,3-oxazol-4-yl]methanamine
CID 114238222
N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine
CID 103539392
N-[[2-(2-ethylmorpholin-4-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 113377635
2-methyl-N-[[2-[2-(2-methylpropoxy)ethoxy]-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 106449650
N-[[2-(3-methoxy-4-methylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-1-amine
CID 102967632
1-[1-[4-[(tert-butylamino)methyl]phenyl]piperidin-4-yl]ethanol
CID 106836685
2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62285028
N-methyl-1-[5-(4-propan-2-ylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methanamine
CID 106967346
N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 113377768
N-[[2-(3-ethylthiophen-2-yl)-1,3-oxazol-4-yl]methyl]-2-methylpropan-2-amine
CID 79975719

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine (CID 103503049) is 2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine is CC(C)C1CCN(c2nc(CNC(C)(C)C)co2)CC1.
What is the InChIKey of 2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The InChIKey is ZBJKMUYXSKNGNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-12(2)13-6-8-19(9-7-13)15-18-14(11-20-15)10-17-16(3,4)5/h11-13,17H,6-10H2,1-5H3.
What are the key properties of 2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine has a molecular weight of 279.43 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 103503049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).