1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine

C19H25N — CID 61482245

IUPAC1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine
SMILESCCNC(Cc1ccccc1)Cc1cc(C)ccc1C
InChIInChI=1S/C19H25N/c1-4-20-19(13-17-8-6-5-7-9-17)14-18-12-15(2)10-11-16(18)3/h5-12,19-20H,4,13-14H2,1-3H3
InChIKeyOURMIMPXPCVIDR-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.07
Rot. Bonds6

About 1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine

1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine (PubChem CID 61482245) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine.

Molecular Properties

Compound Name1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine
PubChem CID61482245
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine
SMILESCCNC(Cc1ccccc1)Cc1cc(C)ccc1C
InChIInChI=1S/C19H25N/c1-4-20-19(13-17-8-6-5-7-9-17)14-18-12-15(2)10-11-16(18)3/h5-12,19-20H,4,13-14H2,1-3H3
InChIKeyOURMIMPXPCVIDR-UHFFFAOYSA-N
XLogP4.07
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-1-(2-methoxy-5-methylphenyl)-3-phenylpropan-2-amine
CID 62160348
1-(2,5-dimethylphenyl)-N-ethylpentan-2-amine
CID 61482090
1-(2,5-dimethylphenyl)-N-ethyl-4-pyridin-4-ylbutan-2-amine
CID 105101158
1-(2-chloro-4-methylphenyl)-N-ethyl-3-(4-methylphenyl)propan-2-amine
CID 106867468
1-(2,5-dimethylphenyl)-N-ethyl-5-methoxypentan-2-amine
CID 65092524
N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine
CID 61065597
1-(3-chlorophenyl)-N-ethyl-3-(5-fluoro-2-methylphenyl)propan-2-amine
CID 105373667
1-(2,5-dimethylphenyl)-N-ethyl-4-thiophen-3-ylbutan-2-amine
CID 115856849
1-(5-bromo-2-pyridinyl)-3-(2,5-dimethylphenyl)-N-ethylpropan-2-amine
CID 105036122
N-ethyl-1-(2-methoxyphenyl)-3-phenylpropan-2-amine
CID 61263100
1-(5-fluoro-2-methylphenyl)-N-methyl-3-phenylpropan-2-amine
CID 105373668
1-(2,5-dimethylphenyl)-3-(3-fluorophenyl)-N-methylpropan-2-amine
CID 61481696

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine?
The IUPAC name of 1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine (CID 61482245) is 1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine.
What is the SMILES notation for 1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine?
The canonical SMILES for 1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine is CCNC(Cc1ccccc1)Cc1cc(C)ccc1C.
What is the InChIKey of 1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine?
The InChIKey is OURMIMPXPCVIDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-4-20-19(13-17-8-6-5-7-9-17)14-18-12-15(2)10-11-16(18)3/h5-12,19-20H,4,13-14H2,1-3H3.
What are the key properties of 1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine?
1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine has a molecular weight of 267.42 g/mol, XLogP of 4.07, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-2-amine is sourced from PubChem (CID 61482245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).