N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine

C10H18N2O2 — CID 62444489

IUPACN-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine
SMILESCCOCc1cc(CNC(C)C)no1
InChIInChI=1S/C10H18N2O2/c1-4-13-7-10-5-9(12-14-10)6-11-8(2)3/h5,8,11H,4,6-7H2,1-3H3
InChIKeyDYHXEBNXGYDXTD-UHFFFAOYSA-N
MW198.27 g/mol
LogP1.71
Rot. Bonds6

About N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine

N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine (PubChem CID 62444489) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine
PubChem CID62444489
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC NameN-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine
SMILESCCOCc1cc(CNC(C)C)no1
InChIInChI=1S/C10H18N2O2/c1-4-13-7-10-5-9(12-14-10)6-11-8(2)3/h5,8,11H,4,6-7H2,1-3H3
InChIKeyDYHXEBNXGYDXTD-UHFFFAOYSA-N
XLogP1.71
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]adamantan-1-amine
CID 127029643
{5-[(Tert-butoxy)methyl]-1,2-oxazol-3-yl}methanamine
CID 62457747
[5-(Methoxymethyl)-1,2-oxazol-3-yl]methanamine hydrochloride
CID 138040690
N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1-(oxolan-2-yl)ethanamine
CID 86788992
1-cyclopropyl-N-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]-5-methylpyrrolidin-3-amine
CID 128701107
N-[(1S)-1-cyclopropylethyl]-5-[(2-methylpropan-2-yl)oxymethyl]-1,2-oxazole-3-carboxamide
CID 137993470
5-(methoxymethyl)-N-[(3S)-1-propanoylpyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 164631414
N-[(1S)-cyclohex-3-en-1-yl]-2-[(3-methyl-1,2-oxazol-5-yl)methoxy]acetamide
CID 164634692
N-[(3R)-4,4-dimethyloxolan-3-yl]-5-[(2-methylpropan-2-yl)oxymethyl]-1,2-oxazole-3-carboxamide
CID 164641962
5-(methoxymethyl)-3-[[(3S)-3-methoxy-3-methylpiperidin-1-yl]methyl]-1,2-oxazole
CID 164642839
3-[(3,3-Difluoroazetidin-1-yl)methyl]-5-(1-ethoxyethyl)-1,2-oxazole
CID 166884990
N-[[5-(2,2,2-trifluoroethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine
CID 55073205

Frequently Asked Questions

What is the IUPAC name of N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine?
The IUPAC name of N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine (CID 62444489) is N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine is CCOCc1cc(CNC(C)C)no1.
What is the InChIKey of N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine?
The InChIKey is DYHXEBNXGYDXTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-4-13-7-10-5-9(12-14-10)6-11-8(2)3/h5,8,11H,4,6-7H2,1-3H3.
What are the key properties of N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine?
N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine has a molecular weight of 198.27 g/mol, XLogP of 1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(ethoxymethyl)-1,2-oxazol-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 62444489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).