2-(dimethylamino)propan-2-ol

C5H13NO — CID 11251968

IUPAC2-(dimethylamino)propan-2-ol
SMILESCN(C)C(C)(C)O
InChIInChI=1S/C5H13NO/c1-5(2,7)6(3)4/h7H,1-4H3
InChIKeyPOIVWEXWFKSJHL-UHFFFAOYSA-N
MW103.16 g/mol
LogP0.28
Rot. Bonds1

About 2-(dimethylamino)propan-2-ol

2-(dimethylamino)propan-2-ol (PubChem CID 11251968) has the molecular formula C5H13NO and a molecular weight of 103.16 g/mol. Its IUPAC name is 2-(dimethylamino)propan-2-ol.

Molecular Properties

Compound Name2-(dimethylamino)propan-2-ol
PubChem CID11251968
Molecular FormulaC5H13NO
Molecular Weight103.16 g/mol
Exact Mass103.10
IUPAC Name2-(dimethylamino)propan-2-ol
SMILESCN(C)C(C)(C)O
InChIInChI=1S/C5H13NO/c1-5(2,7)6(3)4/h7H,1-4H3
InChIKeyPOIVWEXWFKSJHL-UHFFFAOYSA-N
XLogP0.28
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.16
LogP ≤ 50.28
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 2-(dimethylamino)propan-2-ol?
The IUPAC name of 2-(dimethylamino)propan-2-ol (CID 11251968) is 2-(dimethylamino)propan-2-ol.
What is the SMILES notation for 2-(dimethylamino)propan-2-ol?
The canonical SMILES for 2-(dimethylamino)propan-2-ol is CN(C)C(C)(C)O.
What is the InChIKey of 2-(dimethylamino)propan-2-ol?
The InChIKey is POIVWEXWFKSJHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO/c1-5(2,7)6(3)4/h7H,1-4H3.
What are the key properties of 2-(dimethylamino)propan-2-ol?
2-(dimethylamino)propan-2-ol has a molecular weight of 103.16 g/mol, XLogP of 0.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)propan-2-ol is sourced from PubChem (CID 11251968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).