3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol

C19H25NO — CID 62619514

IUPAC3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol
SMILESCCN(CC(C)C(O)c1ccccc1)c1cccc(C)c1
InChIInChI=1S/C19H25NO/c1-4-20(18-12-8-9-15(2)13-18)14-16(3)19(21)17-10-6-5-7-11-17/h5-13,16,19,21H,4,14H2,1-3H3
InChIKeyJHZRUJUOCSDZMT-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.19
Rot. Bonds6

About 3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol

3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol (PubChem CID 62619514) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol.

Molecular Properties

Compound Name3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol
PubChem CID62619514
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol
SMILESCCN(CC(C)C(O)c1ccccc1)c1cccc(C)c1
InChIInChI=1S/C19H25NO/c1-4-20(18-12-8-9-15(2)13-18)14-16(3)19(21)17-10-6-5-7-11-17/h5-13,16,19,21H,4,14H2,1-3H3
InChIKeyJHZRUJUOCSDZMT-UHFFFAOYSA-N
XLogP4.19
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-bromo-2-phenylpropyl)-N-ethyl-3-methylaniline
CID 65016452
2-(N-ethyl-3-methylanilino)-1-pyridin-3-ylethanol
CID 82216494
N,N'-diethyl-N,N'-bis(3-methylphenyl)propane-1,3-diamine
CID 57172568
2-(N-ethylanilino)ethanol;2-(N-ethyl-3-methylanilino)ethanol
CID 67646691
2-(N-ethyl-3-methylanilino)-1-(furan-2-yl)ethanol
CID 82216584
1-(N-ethyl-3-methylanilino)-3-[4-[3-(N-ethyl-3-methylanilino)-2-hydroxypropoxy]phenoxy]propan-2-ol
CID 19133401
N-ethyl-N-[[4-[(N-ethyl-3-methylanilino)methyl]phenyl]methyl]-3-methylaniline
CID 23342282
1-(N-ethyl-3-methylanilino)propan-2-yl hydrogen sulfite
CID 91035286
N,N-diethylaniline;N,N,3-trimethylaniline
CID 67788378
1-(N-ethyl-3-methylanilino)-2-phenylpropan-2-ol
CID 62374821
ethane;2-(N-ethyl-3-methylanilino)ethanol
CID 142945476
3-[ethyl(2-ethylbutyl)amino]-2-methyl-1-phenylpropan-1-ol
CID 62617124

Frequently Asked Questions

What is the IUPAC name of 3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol?
The IUPAC name of 3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol (CID 62619514) is 3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol.
What is the SMILES notation for 3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol?
The canonical SMILES for 3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol is CCN(CC(C)C(O)c1ccccc1)c1cccc(C)c1.
What is the InChIKey of 3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol?
The InChIKey is JHZRUJUOCSDZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-4-20(18-12-8-9-15(2)13-18)14-16(3)19(21)17-10-6-5-7-11-17/h5-13,16,19,21H,4,14H2,1-3H3.
What are the key properties of 3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol?
3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol has a molecular weight of 283.42 g/mol, XLogP of 4.19, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(N-ethyl-3-methylanilino)-2-methyl-1-phenylpropan-1-ol is sourced from PubChem (CID 62619514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).