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

C14H25N3O — CID 113377768

IUPACN-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
SMILESCC1CCN(c2nc(CNC(C)C)co2)C(C)C1
InChIInChI=1S/C14H25N3O/c1-10(2)15-8-13-9-18-14(16-13)17-6-5-11(3)7-12(17)4/h9-12,15H,5-8H2,1-4H3
InChIKeyOEUVBMDRHKRZFM-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.80
Rot. Bonds4

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

N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine (PubChem CID 113377768) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
PubChem CID113377768
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
SMILESCC1CCN(c2nc(CNC(C)C)co2)C(C)C1
InChIInChI=1S/C14H25N3O/c1-10(2)15-8-13-9-18-14(16-13)17-6-5-11(3)7-12(17)4/h9-12,15H,5-8H2,1-4H3
InChIKeyOEUVBMDRHKRZFM-UHFFFAOYSA-N
XLogP2.80
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-(2,4-dimethylpiperidin-1-yl)phenyl]methyl]propan-2-amine
CID 62331056
N-methyl-1-[2-(2,3,5-trimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methanamine
CID 114596926
N-[[2-(2-ethylmorpholin-4-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 113377635
N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methanamine
CID 103503007
N-[[3-[(2,4-dimethylpiperidin-1-yl)methyl]phenyl]methyl]propan-2-amine
CID 62430874
2-methyl-N-[[2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-1,3-oxazol-4-yl]methyl]propan-1-amine
CID 102886799
N-[[5-[(2,4-dimethylpiperidin-1-yl)methyl]-2-methylfuran-3-yl]methyl]propan-2-amine
CID 62431577
N-[[4-[(2,4-dimethylpiperidin-1-yl)methyl]-5-methylfuran-2-yl]methyl]propan-2-amine
CID 62431233
N-[[2-(oxan-4-ylmethoxy)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 113378047
N-[[6-(4-methylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62286089
2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 103503049
N-[[5-[(2-methylpyrrolidin-1-yl)methyl]-1,2-oxazol-3-yl]methyl]propan-2-amine
CID 62438242

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The IUPAC name of N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine (CID 113377768) is N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine is CC1CCN(c2nc(CNC(C)C)co2)C(C)C1.
What is the InChIKey of N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The InChIKey is OEUVBMDRHKRZFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-10(2)15-8-13-9-18-14(16-13)17-6-5-11(3)7-12(17)4/h9-12,15H,5-8H2,1-4H3.
What are the key properties of N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine has a molecular weight of 251.37 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,4-dimethylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 113377768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).