(1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine

C10H17N3O — CID 165474997

IUPAC(1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine
SMILESCC(C)(C)OC[C@H](N)c1ncccn1
InChIInChI=1S/C10H17N3O/c1-10(2,3)14-7-8(11)9-12-5-4-6-13-9/h4-6,8H,7,11H2,1-3H3/t8-/m0/s1
InChIKeyIDUDZHWZOZOHEG-QMMMGPOBSA-N
MW195.27 g/mol
LogP1.29
Rot. Bonds3

About (1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine

(1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine (PubChem CID 165474997) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is (1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine.

Molecular Properties

Compound Name(1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine
PubChem CID165474997
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name(1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine
SMILESCC(C)(C)OC[C@H](N)c1ncccn1
InChIInChI=1S/C10H17N3O/c1-10(2,3)14-7-8(11)9-12-5-4-6-13-9/h4-6,8H,7,11H2,1-3H3/t8-/m0/s1
InChIKeyIDUDZHWZOZOHEG-QMMMGPOBSA-N
XLogP1.29
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-bromofuran-2-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 105150533
3-methyl-1-pyrimidin-2-ylbut-3-en-1-amine
CID 79178492
1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 105146670
1-(5-methoxy-3-pyridinyl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 105175275
1-(cyclohexen-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 106657502
2-[(2-methylpropan-2-yl)oxy]-1-(1-propylpyrazol-4-yl)ethanamine
CID 105103681
(2S)-3,3-dimethyl-1-[(2-methylpropan-2-yl)oxy]butan-2-amine
CID 28998269
(1R)-1-pyrimidin-2-ylethanamine;hydrochloride
CID 146680703
1-(3-chlorothiophen-2-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 107361905
3-[(2-methylpropan-2-yl)oxymethoxy]pyridin-2-amine
CID 20765509
1-[(2-methylpropan-2-yl)oxy]-4-phenylbutan-2-amine
CID 105094062
(1S)-2-methoxy-1-(3-methyl-2-pyridinyl)ethanamine
CID 55293686

Frequently Asked Questions

What is the IUPAC name of (1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine?
The IUPAC name of (1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine (CID 165474997) is (1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine.
What is the SMILES notation for (1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine?
The canonical SMILES for (1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine is CC(C)(C)OC[C@H](N)c1ncccn1.
What is the InChIKey of (1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine?
The InChIKey is IDUDZHWZOZOHEG-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H17N3O/c1-10(2,3)14-7-8(11)9-12-5-4-6-13-9/h4-6,8H,7,11H2,1-3H3/t8-/m0/s1.
What are the key properties of (1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine?
(1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine has a molecular weight of 195.27 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-[(2-methylpropan-2-yl)oxy]-1-pyrimidin-2-ylethanamine is sourced from PubChem (CID 165474997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).