(2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine

C9H19NO2 — CID 28571154

IUPAC(2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine
SMILESCOC[C@@H](C)NC[C@@H]1CCCO1
InChIInChI=1S/C9H19NO2/c1-8(7-11-2)10-6-9-4-3-5-12-9/h8-10H,3-7H2,1-2H3/t8-,9+/m1/s1
InChIKeyUFOVMOICFAMCBY-BDAKNGLRSA-N
MW173.26 g/mol
LogP0.79
Rot. Bonds5

About (2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine

(2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine (PubChem CID 28571154) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is (2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name(2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine
PubChem CID28571154
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name(2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine
SMILESCOC[C@@H](C)NC[C@@H]1CCCO1
InChIInChI=1S/C9H19NO2/c1-8(7-11-2)10-6-9-4-3-5-12-9/h8-10H,3-7H2,1-2H3/t8-,9+/m1/s1
InChIKeyUFOVMOICFAMCBY-BDAKNGLRSA-N
XLogP0.79
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methoxy-N-(oxan-2-ylmethyl)propan-2-amine
CID 43403662
1-fluoro-3-methoxy-N-(oxolan-2-ylmethyl)propan-2-amine
CID 83818042
2-N-[[(2S)-oxolan-2-yl]methyl]-1-N-propan-2-ylpropane-1,2-diamine
CID 104856010
N-(1,4-dioxan-2-ylmethyl)-1-methoxypropan-2-amine
CID 62535870
N-(oxolan-2-ylmethyl)propan-2-amine;hydrochloride
CID 172772952
1-methoxy-N-[3-(oxan-2-yl)propyl]propan-2-amine
CID 104626329
4-methoxy-3-(oxolan-2-ylmethylamino)butan-1-ol
CID 83819615
3-(oxolan-2-ylmethylamino)butan-1-ol
CID 83177846
N-[[(2S)-oxolan-2-yl]methyl]pent-4-en-2-amine
CID 166665828
3-methyl-N-(oxolan-2-ylmethyl)butan-2-amine
CID 43179200
1-methoxy-N-[(5-methyloxolan-2-yl)methyl]propan-2-amine
CID 82833761
4-cyclopentyl-N-(oxolan-2-ylmethyl)butan-2-amine
CID 115705992

Frequently Asked Questions

What is the IUPAC name of (2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine?
The IUPAC name of (2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine (CID 28571154) is (2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine.
What is the SMILES notation for (2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine?
The canonical SMILES for (2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine is COC[C@@H](C)NC[C@@H]1CCCO1.
What is the InChIKey of (2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine?
The InChIKey is UFOVMOICFAMCBY-BDAKNGLRSA-N. The full InChI is InChI=1S/C9H19NO2/c1-8(7-11-2)10-6-9-4-3-5-12-9/h8-10H,3-7H2,1-2H3/t8-,9+/m1/s1.
What are the key properties of (2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine?
(2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine has a molecular weight of 173.26 g/mol, XLogP of 0.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-methoxy-N-[[(2S)-oxolan-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 28571154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).