2-methyl-1-(2-methylpropoxyamino)propan-2-ol

C8H19NO2 — CID 82715406

IUPAC2-methyl-1-(2-methylpropoxyamino)propan-2-ol
SMILESCC(C)CONCC(C)(C)O
InChIInChI=1S/C8H19NO2/c1-7(2)5-11-9-6-8(3,4)10/h7,9-10H,5-6H2,1-4H3
InChIKeyIZDINSAYEDWZGL-UHFFFAOYSA-N
MW161.24 g/mol
LogP0.93
Rot. Bonds5

About 2-methyl-1-(2-methylpropoxyamino)propan-2-ol

2-methyl-1-(2-methylpropoxyamino)propan-2-ol (PubChem CID 82715406) has the molecular formula C8H19NO2 and a molecular weight of 161.24 g/mol. Its IUPAC name is 2-methyl-1-(2-methylpropoxyamino)propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(2-methylpropoxyamino)propan-2-ol
PubChem CID82715406
Molecular FormulaC8H19NO2
Molecular Weight161.24 g/mol
Exact Mass161.14
IUPAC Name2-methyl-1-(2-methylpropoxyamino)propan-2-ol
SMILESCC(C)CONCC(C)(C)O
InChIInChI=1S/C8H19NO2/c1-7(2)5-11-9-6-8(3,4)10/h7,9-10H,5-6H2,1-4H3
InChIKeyIZDINSAYEDWZGL-UHFFFAOYSA-N
XLogP0.93
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.24
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methylpropoxyamino)propan-2-ol?
The IUPAC name of 2-methyl-1-(2-methylpropoxyamino)propan-2-ol (CID 82715406) is 2-methyl-1-(2-methylpropoxyamino)propan-2-ol.
What is the SMILES notation for 2-methyl-1-(2-methylpropoxyamino)propan-2-ol?
The canonical SMILES for 2-methyl-1-(2-methylpropoxyamino)propan-2-ol is CC(C)CONCC(C)(C)O.
What is the InChIKey of 2-methyl-1-(2-methylpropoxyamino)propan-2-ol?
The InChIKey is IZDINSAYEDWZGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2/c1-7(2)5-11-9-6-8(3,4)10/h7,9-10H,5-6H2,1-4H3.
What are the key properties of 2-methyl-1-(2-methylpropoxyamino)propan-2-ol?
2-methyl-1-(2-methylpropoxyamino)propan-2-ol has a molecular weight of 161.24 g/mol, XLogP of 0.93, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methylpropoxyamino)propan-2-ol is sourced from PubChem (CID 82715406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).