N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine

C15H25N — CID 138483696

IUPACN,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine
SMILESCCN(CC)CCc1ccc(C(C)C)cc1
InChIInChI=1S/C15H25N/c1-5-16(6-2)12-11-14-7-9-15(10-8-14)13(3)4/h7-10,13H,5-6,11-12H2,1-4H3
InChIKeyDNCKEXITCUJQMY-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.69
Rot. Bonds6

About N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine

N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine (PubChem CID 138483696) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine.

Molecular Properties

Compound NameN,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine
PubChem CID138483696
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC NameN,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine
SMILESCCN(CC)CCc1ccc(C(C)C)cc1
InChIInChI=1S/C15H25N/c1-5-16(6-2)12-11-14-7-9-15(10-8-14)13(3)4/h7-10,13H,5-6,11-12H2,1-4H3
InChIKeyDNCKEXITCUJQMY-UHFFFAOYSA-N
XLogP3.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N',N'-diethyl-N-[(4-propan-2-ylphenyl)methyl]ethane-1,2-diamine;dihydrochloride
CID 17331877
N'-ethyl-N,N-dimethyl-N'-[(4-propan-2-ylphenyl)methyl]ethane-1,2-diamine
CID 782609
ethane;3-(4-propan-2-ylphenyl)propane-1-thiol
CID 144873954
ethane;1-ethyl-4-propan-2-ylbenzene
CID 145053715
1-butyl-4-propan-2-ylbenzene;hexane
CID 142937575
1-butyl-4-propan-2-ylbenzene;1,4-di(propan-2-yl)benzene;methane
CID 176687578
N-[4-[2-(dipropylamino)ethyl]phenyl]-4-propan-2-ylbenzenesulfonamide
CID 11676519
1-methyl-1-[2-(4-propan-2-ylphenyl)ethyl]urea
CID 115168591
1-butyl-4-ethylbenzene;ethane;1-ethyl-4-propan-2-ylbenzene;methane
CID 176687496
1-N-[4-[2-(diethylamino)ethyl]phenyl]-3-methylbutane-1,2-diamine
CID 83963008
3-methyl-2-[methyl-[2-(4-propan-2-ylphenyl)ethyl]amino]butan-1-ol
CID 115137765
ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene
CID 143715376

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine?
The IUPAC name of N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine (CID 138483696) is N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine.
What is the SMILES notation for N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine?
The canonical SMILES for N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine is CCN(CC)CCc1ccc(C(C)C)cc1.
What is the InChIKey of N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine?
The InChIKey is DNCKEXITCUJQMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-5-16(6-2)12-11-14-7-9-15(10-8-14)13(3)4/h7-10,13H,5-6,11-12H2,1-4H3.
What are the key properties of N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine?
N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine has a molecular weight of 219.37 g/mol, XLogP of 3.69, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(4-propan-2-ylphenyl)ethanamine is sourced from PubChem (CID 138483696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).