N-(2,2-diphenylethyl)-2-ethylbutan-1-amine

C20H27N — CID 103603252

IUPACN-(2,2-diphenylethyl)-2-ethylbutan-1-amine
SMILESCCC(CC)CNCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H27N/c1-3-17(4-2)15-21-16-20(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14,17,20-21H,3-4,15-16H2,1-2H3
InChIKeySWYHHDLUXPDPCU-UHFFFAOYSA-N
MW281.44 g/mol
LogP4.84
Rot. Bonds8

About N-(2,2-diphenylethyl)-2-ethylbutan-1-amine

N-(2,2-diphenylethyl)-2-ethylbutan-1-amine (PubChem CID 103603252) has the molecular formula C20H27N and a molecular weight of 281.44 g/mol. Its IUPAC name is N-(2,2-diphenylethyl)-2-ethylbutan-1-amine.

Molecular Properties

Compound NameN-(2,2-diphenylethyl)-2-ethylbutan-1-amine
PubChem CID103603252
Molecular FormulaC20H27N
Molecular Weight281.44 g/mol
Exact Mass281.21
IUPAC NameN-(2,2-diphenylethyl)-2-ethylbutan-1-amine
SMILESCCC(CC)CNCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H27N/c1-3-17(4-2)15-21-16-20(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14,17,20-21H,3-4,15-16H2,1-2H3
InChIKeySWYHHDLUXPDPCU-UHFFFAOYSA-N
XLogP4.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,2-diphenylethyl)-2-methylbutan-1-amine
CID 107292737
N-(2,2-diethoxyethyl)-2,2-diphenylethanamine
CID 70269046
2-ethyl-N-(1-phenylethyl)butan-1-amine
CID 43177121
N-butyl-N'-(2,2-diphenylethyl)ethane-1,2-diamine
CID 23394686
N-(2-chloro-1-phenylethyl)-2-ethylbutan-1-amine
CID 82924271
N-(2,2-diphenylethyl)-2-methylsulfinylpropan-1-amine
CID 103897213
(2R)-2-phenyl-N-[(2S)-2-phenylpropyl]propan-1-amine
CID 7054159
(2S)-2-(2-ethylbutylamino)-2-phenylacetic acid
CID 122038582
N-(2,2-difluoro-2-phenylethyl)-2-ethylbutan-1-amine
CID 116789342
N-[[5-(ethylaminomethyl)naphthalen-1-yl]methyl]-2,2-diphenylethanamine
CID 130243752
N-(2,2-diphenylethyl)-2-methyl-2-methylsulfanylpropan-1-amine
CID 107292773
N-(2,2-diphenylethyl)-N',N'-dimethylpropane-1,3-diamine
CID 103603219

Frequently Asked Questions

What is the IUPAC name of N-(2,2-diphenylethyl)-2-ethylbutan-1-amine?
The IUPAC name of N-(2,2-diphenylethyl)-2-ethylbutan-1-amine (CID 103603252) is N-(2,2-diphenylethyl)-2-ethylbutan-1-amine.
What is the SMILES notation for N-(2,2-diphenylethyl)-2-ethylbutan-1-amine?
The canonical SMILES for N-(2,2-diphenylethyl)-2-ethylbutan-1-amine is CCC(CC)CNCC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2,2-diphenylethyl)-2-ethylbutan-1-amine?
The InChIKey is SWYHHDLUXPDPCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N/c1-3-17(4-2)15-21-16-20(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14,17,20-21H,3-4,15-16H2,1-2H3.
What are the key properties of N-(2,2-diphenylethyl)-2-ethylbutan-1-amine?
N-(2,2-diphenylethyl)-2-ethylbutan-1-amine has a molecular weight of 281.44 g/mol, XLogP of 4.84, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-diphenylethyl)-2-ethylbutan-1-amine is sourced from PubChem (CID 103603252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).