(2R)-2-[amino(methyl)amino]-2-phenylethanol

C9H14N2O — CID 11693961

IUPAC(2R)-2-[amino(methyl)amino]-2-phenylethanol
SMILESCN(N)[C@@H](CO)c1ccccc1
InChIInChI=1S/C9H14N2O/c1-11(10)9(7-12)8-5-3-2-4-6-8/h2-6,9,12H,7,10H2,1H3/t9-/m0/s1
InChIKeyDEIHVBKHFGULRT-VIFPVBQESA-N
MW166.22 g/mol
LogP0.53
Rot. Bonds3

About (2R)-2-[amino(methyl)amino]-2-phenylethanol

(2R)-2-[amino(methyl)amino]-2-phenylethanol (PubChem CID 11693961) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is (2R)-2-[amino(methyl)amino]-2-phenylethanol.

Molecular Properties

Compound Name(2R)-2-[amino(methyl)amino]-2-phenylethanol
PubChem CID11693961
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name(2R)-2-[amino(methyl)amino]-2-phenylethanol
SMILESCN(N)[C@@H](CO)c1ccccc1
InChIInChI=1S/C9H14N2O/c1-11(10)9(7-12)8-5-3-2-4-6-8/h2-6,9,12H,7,10H2,1H3/t9-/m0/s1
InChIKeyDEIHVBKHFGULRT-VIFPVBQESA-N
XLogP0.53
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 50.53
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'}

Analyze (2R)-2-[amino(methyl)amino]-2-phenylethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-(dimethylamino)-2-phenylethanol
CID 10888273
(2R)-2-[methyl-[(1R)-1-phenylethyl]amino]-2-phenylethanol
CID 14738807
(2R)-2-(diethylamino)-2-phenylethanol
CID 13119692
(2R)-2-[amino(benzyl)amino]-2-phenylethanol
CID 15856855
(2S)-2-amino-2-phenylethanol;methanol
CID 160824062
lithium 2-[bis(2-hydroxy-1-phenylethyl)amino]ethanesulfonate
CID 59343960
N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide
CID 11748505
(1S)-N,N,N',N'-tetramethyl-1-phenylethane-1,2-diamine
CID 134927015
N,N-dimethyl-1-phenylpropan-1-amine;ethane
CID 144553481
5-[(2-amino-1-phenylethyl)-methylamino]pentan-1-ol
CID 107198422
(2S)-2-[methyl-[[(1S,2R)-2-propylcyclopropyl]methyl]amino]-2-phenylethanol
CID 101266753
2-[benzyl(methyl)amino]-1-phenylethanol;2-[benzyl(methyl)amino]-2-phenylethanol
CID 110192818

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[amino(methyl)amino]-2-phenylethanol?
The IUPAC name of (2R)-2-[amino(methyl)amino]-2-phenylethanol (CID 11693961) is (2R)-2-[amino(methyl)amino]-2-phenylethanol.
What is the SMILES notation for (2R)-2-[amino(methyl)amino]-2-phenylethanol?
The canonical SMILES for (2R)-2-[amino(methyl)amino]-2-phenylethanol is CN(N)[C@@H](CO)c1ccccc1.
What is the InChIKey of (2R)-2-[amino(methyl)amino]-2-phenylethanol?
The InChIKey is DEIHVBKHFGULRT-VIFPVBQESA-N. The full InChI is InChI=1S/C9H14N2O/c1-11(10)9(7-12)8-5-3-2-4-6-8/h2-6,9,12H,7,10H2,1H3/t9-/m0/s1.
What are the key properties of (2R)-2-[amino(methyl)amino]-2-phenylethanol?
(2R)-2-[amino(methyl)amino]-2-phenylethanol has a molecular weight of 166.22 g/mol, XLogP of 0.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[amino(methyl)amino]-2-phenylethanol is sourced from PubChem (CID 11693961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).