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

C19H25N — CID 66437881

IUPAC1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine
SMILESCCNC(C)C(c1ccccc1)c1cc(C)ccc1C
InChIInChI=1S/C19H25N/c1-5-20-16(4)19(17-9-7-6-8-10-17)18-13-14(2)11-12-15(18)3/h6-13,16,19-20H,5H2,1-4H3
InChIKeyBDXMVUHTYQSDKN-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.43
Rot. Bonds5

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

1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine (PubChem CID 66437881) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine.

Molecular Properties

Compound Name1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine
PubChem CID66437881
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine
SMILESCCNC(C)C(c1ccccc1)c1cc(C)ccc1C
InChIInChI=1S/C19H25N/c1-5-20-16(4)19(17-9-7-6-8-10-17)18-13-14(2)11-12-15(18)3/h6-13,16,19-20H,5H2,1-4H3
InChIKeyBDXMVUHTYQSDKN-UHFFFAOYSA-N
XLogP4.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,5-dimethylphenyl)-1-phenylbutan-2-ol
CID 79299341
2-(2-bromo-3-methyl-1-phenylbutyl)-1,4-dimethylbenzene
CID 79297893
1-(2,5-dimethylphenyl)-N-ethyl-3-phenylpropan-1-amine
CID 43490830
1-(2,5-dimethylphenyl)-N-ethylpropan-1-amine
CID 43490783
4-(2,5-dimethylphenyl)-N-ethylpentan-2-amine
CID 64718536
N-[2-(2,5-dimethylphenyl)-2-phenylethyl]propan-1-amine
CID 66438254
2-[[(2,5-dimethylphenyl)-phenylmethyl]amino]ethanol
CID 43151186
N-[1-(2,5-dimethylphenyl)ethyl]-1-phenylbutan-1-amine
CID 43720303
2-(2-chloro-1-phenylethyl)-1,4-dimethylbenzene
CID 66436960
N-[(2,5-dimethylphenyl)-(3,4-dimethylphenyl)methyl]ethanamine
CID 43487964
1-(2,5-dimethylphenyl)-N-ethyl-4-methylpentan-1-amine
CID 43490798
2-[[(2,5-dimethylphenyl)-phenylmethyl]amino]acetic acid
CID 43135171

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine?
The IUPAC name of 1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine (CID 66437881) is 1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine.
What is the SMILES notation for 1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine?
The canonical SMILES for 1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine is CCNC(C)C(c1ccccc1)c1cc(C)ccc1C.
What is the InChIKey of 1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine?
The InChIKey is BDXMVUHTYQSDKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-5-20-16(4)19(17-9-7-6-8-10-17)18-13-14(2)11-12-15(18)3/h6-13,16,19-20H,5H2,1-4H3.
What are the key properties of 1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine?
1-(2,5-dimethylphenyl)-N-ethyl-1-phenylpropan-2-amine has a molecular weight of 267.42 g/mol, XLogP of 4.43, 5 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-1-phenylpropan-2-amine is sourced from PubChem (CID 66437881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).