2-methyl-3-(propan-2-ylamino)butan-2-ol

C8H19NO — CID 65332894

IUPAC2-methyl-3-(propan-2-ylamino)butan-2-ol
SMILESCC(C)NC(C)C(C)(C)O
InChIInChI=1S/C8H19NO/c1-6(2)9-7(3)8(4,5)10/h6-7,9-10H,1-5H3
InChIKeyLUAGSAZASUYZEI-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.14
Rot. Bonds3

About 2-methyl-3-(propan-2-ylamino)butan-2-ol

2-methyl-3-(propan-2-ylamino)butan-2-ol (PubChem CID 65332894) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 2-methyl-3-(propan-2-ylamino)butan-2-ol.

Molecular Properties

Compound Name2-methyl-3-(propan-2-ylamino)butan-2-ol
PubChem CID65332894
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name2-methyl-3-(propan-2-ylamino)butan-2-ol
SMILESCC(C)NC(C)C(C)(C)O
InChIInChI=1S/C8H19NO/c1-6(2)9-7(3)8(4,5)10/h6-7,9-10H,1-5H3
InChIKeyLUAGSAZASUYZEI-UHFFFAOYSA-N
XLogP1.14
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(propan-2-ylamino)butan-2-ol?
The IUPAC name of 2-methyl-3-(propan-2-ylamino)butan-2-ol (CID 65332894) is 2-methyl-3-(propan-2-ylamino)butan-2-ol.
What is the SMILES notation for 2-methyl-3-(propan-2-ylamino)butan-2-ol?
The canonical SMILES for 2-methyl-3-(propan-2-ylamino)butan-2-ol is CC(C)NC(C)C(C)(C)O.
What is the InChIKey of 2-methyl-3-(propan-2-ylamino)butan-2-ol?
The InChIKey is LUAGSAZASUYZEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-6(2)9-7(3)8(4,5)10/h6-7,9-10H,1-5H3.
What are the key properties of 2-methyl-3-(propan-2-ylamino)butan-2-ol?
2-methyl-3-(propan-2-ylamino)butan-2-ol has a molecular weight of 145.25 g/mol, XLogP of 1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(propan-2-ylamino)butan-2-ol is sourced from PubChem (CID 65332894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).