2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol

C10H23NO — CID 62271279

IUPAC2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol
SMILESCC(C)CN(C)CC(C)(C)CO
InChIInChI=1S/C10H23NO/c1-9(2)6-11(5)7-10(3,4)8-12/h9,12H,6-8H2,1-5H3
InChIKeyDXNNEOCXYCTUQF-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.59
Rot. Bonds5

About 2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol

2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol (PubChem CID 62271279) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol
PubChem CID62271279
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol
SMILESCC(C)CN(C)CC(C)(C)CO
InChIInChI=1S/C10H23NO/c1-9(2)6-11(5)7-10(3,4)8-12/h9,12H,6-8H2,1-5H3
InChIKeyDXNNEOCXYCTUQF-UHFFFAOYSA-N
XLogP1.59
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol?
The IUPAC name of 2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol (CID 62271279) is 2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol.
What is the SMILES notation for 2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol?
The canonical SMILES for 2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol is CC(C)CN(C)CC(C)(C)CO.
What is the InChIKey of 2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol?
The InChIKey is DXNNEOCXYCTUQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-9(2)6-11(5)7-10(3,4)8-12/h9,12H,6-8H2,1-5H3.
What are the key properties of 2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol?
2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol has a molecular weight of 173.30 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-[methyl(2-methylpropyl)amino]propan-1-ol is sourced from PubChem (CID 62271279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).