3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol

C18H24N2O — CID 64791750

IUPAC3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
SMILESCNC(CO)(CN(C)c1ccccc1C)c1ccccc1
InChIInChI=1S/C18H24N2O/c1-15-9-7-8-12-17(15)20(3)13-18(14-21,19-2)16-10-5-4-6-11-16/h4-12,19,21H,13-14H2,1-3H3
InChIKeyQHACNWOBTMFXAB-UHFFFAOYSA-N
MW284.40 g/mol
LogP2.54
Rot. Bonds6

About 3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol

3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol (PubChem CID 64791750) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol.

Molecular Properties

Compound Name3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
PubChem CID64791750
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
SMILESCNC(CO)(CN(C)c1ccccc1C)c1ccccc1
InChIInChI=1S/C18H24N2O/c1-15-9-7-8-12-17(15)20(3)13-18(14-21,19-2)16-10-5-4-6-11-16/h4-12,19,21H,13-14H2,1-3H3
InChIKeyQHACNWOBTMFXAB-UHFFFAOYSA-N
XLogP2.54
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(N,4-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
CID 64792121
2-(methylamino)-3-[methyl(propyl)amino]-2-phenylpropan-1-ol
CID 64796564
3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
CID 64797612
3-[cyclobutylmethyl(methyl)amino]-2-(methylamino)-2-phenylpropan-1-ol
CID 64787052
2-cyclopropyl-3-(N,2-dimethylanilino)-2-(methylamino)propanoic acid
CID 63919631
3-[1-methoxypropan-2-yl(methyl)amino]-2-(methylamino)-2-phenylpropan-1-ol
CID 64826513
4-[butyl(methyl)amino]-2-(methylamino)-2-phenylbutan-1-ol
CID 116695023
2-(methylamino)-3-(2-methylimidazol-1-yl)-2-phenylpropan-1-ol
CID 64811940
4-(2-methoxyethoxy)-2-(methylamino)-2-phenylbutan-1-ol
CID 116695482
2-(methylamino)-4-[methyl(pentan-2-yl)amino]-2-phenylbutan-1-ol
CID 116695166
2,2-diethyl-N'-methyl-N'-(2-methylphenyl)propane-1,3-diamine
CID 62260800
4-ethylsulfanyl-2-(methylamino)-2-phenylbutan-1-ol
CID 116695709

Frequently Asked Questions

What is the IUPAC name of 3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol?
The IUPAC name of 3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol (CID 64791750) is 3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol.
What is the SMILES notation for 3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol?
The canonical SMILES for 3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol is CNC(CO)(CN(C)c1ccccc1C)c1ccccc1.
What is the InChIKey of 3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol?
The InChIKey is QHACNWOBTMFXAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-15-9-7-8-12-17(15)20(3)13-18(14-21,19-2)16-10-5-4-6-11-16/h4-12,19,21H,13-14H2,1-3H3.
What are the key properties of 3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol?
3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol has a molecular weight of 284.40 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol is sourced from PubChem (CID 64791750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).