N-ethyl-2,4-diphenylbutan-1-amine

C18H23N — CID 81024071

IUPACN-ethyl-2,4-diphenylbutan-1-amine
SMILESCCNCC(CCc1ccccc1)c1ccccc1
InChIInChI=1S/C18H23N/c1-2-19-15-18(17-11-7-4-8-12-17)14-13-16-9-5-3-6-10-16/h3-12,18-19H,2,13-15H2,1H3
InChIKeyPTAZJRXMMHTOGI-UHFFFAOYSA-N
MW253.39 g/mol
LogP4.01
Rot. Bonds7

About N-ethyl-2,4-diphenylbutan-1-amine

N-ethyl-2,4-diphenylbutan-1-amine (PubChem CID 81024071) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is N-ethyl-2,4-diphenylbutan-1-amine.

Molecular Properties

Compound NameN-ethyl-2,4-diphenylbutan-1-amine
PubChem CID81024071
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC NameN-ethyl-2,4-diphenylbutan-1-amine
SMILESCCNCC(CCc1ccccc1)c1ccccc1
InChIInChI=1S/C18H23N/c1-2-19-15-18(17-11-7-4-8-12-17)14-13-16-9-5-3-6-10-16/h3-12,18-19H,2,13-15H2,1H3
InChIKeyPTAZJRXMMHTOGI-UHFFFAOYSA-N
XLogP4.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-bromophenyl)-N-ethyl-2-phenylbutan-1-amine
CID 81024527
N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine
CID 102940555
N-ethyl-4-(1-methylpyrazol-3-yl)-2-phenylbutan-1-amine
CID 82881887
4-(2,4-difluorophenyl)-N-ethyl-2-phenylbutan-1-amine
CID 81027876
5-ethoxy-N-ethyl-2-phenylpentan-1-amine
CID 65430782
N-ethyl-6-methoxy-2-phenylhexan-1-amine
CID 81024742
4-(2-chloro-6-fluorophenyl)-N-ethyl-2-phenylbutan-1-amine
CID 81027454
[1-(2,4-diphenylbutyl)-3-phenylhexyl]benzene
CID 119080873
4-(3-chlorophenyl)-N-methyl-2-phenylbutan-1-amine
CID 81023908
N-methyl-2-phenyl-N'-(3-phenylpropyl)pentane-1,5-diamine
CID 70494547
4-cyclopentyl-N-ethyl-2-phenylbutan-1-amine
CID 81024739
N-ethyl-4-(2-methoxyethoxy)-2-phenylbutan-1-amine
CID 65430591

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4-diphenylbutan-1-amine?
The IUPAC name of N-ethyl-2,4-diphenylbutan-1-amine (CID 81024071) is N-ethyl-2,4-diphenylbutan-1-amine.
What is the SMILES notation for N-ethyl-2,4-diphenylbutan-1-amine?
The canonical SMILES for N-ethyl-2,4-diphenylbutan-1-amine is CCNCC(CCc1ccccc1)c1ccccc1.
What is the InChIKey of N-ethyl-2,4-diphenylbutan-1-amine?
The InChIKey is PTAZJRXMMHTOGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-2-19-15-18(17-11-7-4-8-12-17)14-13-16-9-5-3-6-10-16/h3-12,18-19H,2,13-15H2,1H3.
What are the key properties of N-ethyl-2,4-diphenylbutan-1-amine?
N-ethyl-2,4-diphenylbutan-1-amine has a molecular weight of 253.39 g/mol, XLogP of 4.01, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4-diphenylbutan-1-amine is sourced from PubChem (CID 81024071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).