3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane

C10H23NO2 — CID 177012878

IUPAC3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane
SMILESCCC.CN(CCCO)C1COC1
InChIInChI=1S/C7H15NO2.C3H8/c1-8(3-2-4-9)7-5-10-6-7;1-3-2/h7,9H,2-6H2,1H3;3H2,1-2H3
InChIKeyBVXCXBQGJZMFGT-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.12
Rot. Bonds4

About 3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane

3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane (PubChem CID 177012878) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane.

Molecular Properties

Compound Name3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane
PubChem CID177012878
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane
SMILESCCC.CN(CCCO)C1COC1
InChIInChI=1S/C7H15NO2.C3H8/c1-8(3-2-4-9)7-5-10-6-7;1-3-2/h7,9H,2-6H2,1H3;3H2,1-2H3
InChIKeyBVXCXBQGJZMFGT-UHFFFAOYSA-N
XLogP1.12
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane?
The IUPAC name of 3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane (CID 177012878) is 3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane.
What is the SMILES notation for 3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane?
The canonical SMILES for 3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane is CCC.CN(CCCO)C1COC1.
What is the InChIKey of 3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane?
The InChIKey is BVXCXBQGJZMFGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2.C3H8/c1-8(3-2-4-9)7-5-10-6-7;1-3-2/h7,9H,2-6H2,1H3;3H2,1-2H3.
What are the key properties of 3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane?
3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane has a molecular weight of 189.30 g/mol, XLogP of 1.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl(oxetan-3-yl)amino]propan-1-ol;propane is sourced from PubChem (CID 177012878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).