(1R)-1-methoxypropan-1-amine

C4H11NO — CID 14619211

IUPAC(1R)-1-methoxypropan-1-amine
SMILESCC[C@H](N)OC
InChIInChI=1S/C4H11NO/c1-3-4(5)6-2/h4H,3,5H2,1-2H3/t4-/m1/s1
InChIKeyKNYKHCLCBHSFCK-SCSAIBSYSA-N
MW89.14 g/mol
LogP0.33
Rot. Bonds2

About (1R)-1-methoxypropan-1-amine

(1R)-1-methoxypropan-1-amine (PubChem CID 14619211) has the molecular formula C4H11NO and a molecular weight of 89.14 g/mol. Its IUPAC name is (1R)-1-methoxypropan-1-amine.

Molecular Properties

Compound Name(1R)-1-methoxypropan-1-amine
PubChem CID14619211
Molecular FormulaC4H11NO
Molecular Weight89.14 g/mol
Exact Mass89.08
IUPAC Name(1R)-1-methoxypropan-1-amine
SMILESCC[C@H](N)OC
InChIInChI=1S/C4H11NO/c1-3-4(5)6-2/h4H,3,5H2,1-2H3/t4-/m1/s1
InChIKeyKNYKHCLCBHSFCK-SCSAIBSYSA-N
XLogP0.33
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.14
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-methoxypropan-1-amine?
The IUPAC name of (1R)-1-methoxypropan-1-amine (CID 14619211) is (1R)-1-methoxypropan-1-amine.
What is the SMILES notation for (1R)-1-methoxypropan-1-amine?
The canonical SMILES for (1R)-1-methoxypropan-1-amine is CC[C@H](N)OC.
What is the InChIKey of (1R)-1-methoxypropan-1-amine?
The InChIKey is KNYKHCLCBHSFCK-SCSAIBSYSA-N. The full InChI is InChI=1S/C4H11NO/c1-3-4(5)6-2/h4H,3,5H2,1-2H3/t4-/m1/s1.
What are the key properties of (1R)-1-methoxypropan-1-amine?
(1R)-1-methoxypropan-1-amine has a molecular weight of 89.14 g/mol, XLogP of 0.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-methoxypropan-1-amine is sourced from PubChem (CID 14619211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).