3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol

C18H24N2O — CID 64797612

IUPAC3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
SMILESCCN(CC(CO)(NC)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H24N2O/c1-3-20(17-12-8-5-9-13-17)14-18(15-21,19-2)16-10-6-4-7-11-16/h4-13,19,21H,3,14-15H2,1-2H3
InChIKeyKUISCDZTKAFBAS-UHFFFAOYSA-N
MW284.40 g/mol
LogP2.62
Rot. Bonds7

About 3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol

3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol (PubChem CID 64797612) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol.

Molecular Properties

Compound Name3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
PubChem CID64797612
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
SMILESCCN(CC(CO)(NC)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H24N2O/c1-3-20(17-12-8-5-9-13-17)14-18(15-21,19-2)16-10-6-4-7-11-16/h4-13,19,21H,3,14-15H2,1-2H3
InChIKeyKUISCDZTKAFBAS-UHFFFAOYSA-N
XLogP2.62
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(methylamino)-3-[methyl(propyl)amino]-2-phenylpropan-1-ol
CID 64796564
3-(N,4-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
CID 64792121
3-(N,2-dimethylanilino)-2-(methylamino)-2-phenylpropan-1-ol
CID 64791750
3-[1-methoxypropan-2-yl(methyl)amino]-2-(methylamino)-2-phenylpropan-1-ol
CID 64826513
3-[cyclobutylmethyl(methyl)amino]-2-(methylamino)-2-phenylpropan-1-ol
CID 64787052
4-ethylsulfanyl-2-(methylamino)-2-phenylbutan-1-ol
CID 116695709
3-(N-butylanilino)-2-methyl-2-(methylamino)propan-1-ol
CID 64810426
N,N-diethylaniline
CID 7061
4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)-2-phenylbutan-1-ol
CID 116695217
4-[butyl(methyl)amino]-2-(methylamino)-2-phenylbutan-1-ol
CID 116695023
3-butylsulfanyl-2-(methylamino)-2-phenylpropan-1-ol
CID 64819019
2-(methylamino)-4-[methyl(pentan-2-yl)amino]-2-phenylbutan-1-ol
CID 116695166

Frequently Asked Questions

What is the IUPAC name of 3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol?
The IUPAC name of 3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol (CID 64797612) is 3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol.
What is the SMILES notation for 3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol?
The canonical SMILES for 3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol is CCN(CC(CO)(NC)c1ccccc1)c1ccccc1.
What is the InChIKey of 3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol?
The InChIKey is KUISCDZTKAFBAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-3-20(17-12-8-5-9-13-17)14-18(15-21,19-2)16-10-6-4-7-11-16/h4-13,19,21H,3,14-15H2,1-2H3.
What are the key properties of 3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol?
3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol has a molecular weight of 284.40 g/mol, XLogP of 2.62, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(N-ethylanilino)-2-(methylamino)-2-phenylpropan-1-ol is sourced from PubChem (CID 64797612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).