2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol

C11H18N2O — CID 21361108

IUPAC2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol
SMILESCN(N)C(C)(C)C(O)c1ccccc1
InChIInChI=1S/C11H18N2O/c1-11(2,13(3)12)10(14)9-7-5-4-6-8-9/h4-8,10,14H,12H2,1-3H3
InChIKeyHYAUHYZPOATSIA-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.30
Rot. Bonds3

About 2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol

2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol (PubChem CID 21361108) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol.

Molecular Properties

Compound Name2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol
PubChem CID21361108
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol
SMILESCN(N)C(C)(C)C(O)c1ccccc1
InChIInChI=1S/C11H18N2O/c1-11(2,13(3)12)10(14)9-7-5-4-6-8-9/h4-8,10,14H,12H2,1-3H3
InChIKeyHYAUHYZPOATSIA-UHFFFAOYSA-N
XLogP1.30
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol?
The IUPAC name of 2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol (CID 21361108) is 2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol.
What is the SMILES notation for 2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol?
The canonical SMILES for 2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol is CN(N)C(C)(C)C(O)c1ccccc1.
What is the InChIKey of 2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol?
The InChIKey is HYAUHYZPOATSIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-11(2,13(3)12)10(14)9-7-5-4-6-8-9/h4-8,10,14H,12H2,1-3H3.
What are the key properties of 2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol?
2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol has a molecular weight of 194.28 g/mol, XLogP of 1.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[amino(methyl)amino]-2-methyl-1-phenylpropan-1-ol is sourced from PubChem (CID 21361108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).