N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine

C18H23N — CID 43495145

IUPACN-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine
SMILESCCCNC(Cc1ccccc1)c1ccc(C)cc1
InChIInChI=1S/C18H23N/c1-3-13-19-18(14-16-7-5-4-6-8-16)17-11-9-15(2)10-12-17/h4-12,18-19H,3,13-14H2,1-2H3
InChIKeyAYWRGXQJDADARJ-UHFFFAOYSA-N
MW253.39 g/mol
LogP4.28
Rot. Bonds6

About N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine

N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine (PubChem CID 43495145) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine
PubChem CID43495145
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC NameN-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine
SMILESCCCNC(Cc1ccccc1)c1ccc(C)cc1
InChIInChI=1S/C18H23N/c1-3-13-19-18(14-16-7-5-4-6-8-16)17-11-9-15(2)10-12-17/h4-12,18-19H,3,13-14H2,1-2H3
InChIKeyAYWRGXQJDADARJ-UHFFFAOYSA-N
XLogP4.28
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(4-methylphenyl)-1-phenylethyl]propan-1-amine
CID 43494855
N-[(1S)-1,2-diphenylethyl]propan-1-amine
CID 36689865
N-[1-(4-iodophenyl)-2-(4-methylphenyl)ethyl]propan-1-amine
CID 63527594
N',N'-diethyl-N-[1-(4-methylphenyl)-2-phenylethyl]ethane-1,2-diamine
CID 145453268
N-[1-(4-methoxyphenyl)-2-phenylethyl]propan-1-amine
CID 43495037
N-[1-phenyl-2-(4-propan-2-ylphenyl)ethyl]propan-1-amine
CID 63413063
N-[1-(3-chloro-4-methylphenyl)-2-phenylethyl]propan-1-amine
CID 63527074
N-[2-(2-chlorophenyl)-1-(4-methylphenyl)ethyl]propan-1-amine
CID 43495095
N-[1-(4-ethylphenyl)-2-(3-methylphenyl)ethyl]propan-1-amine
CID 60819207
1-[[1-(4-methylphenyl)-2-phenylethyl]amino]propan-2-ol;hydrochloride
CID 54605176
N-[1-(3,5-difluorophenyl)-2-(4-methylphenyl)ethyl]propan-1-amine
CID 63417284
N-[1-(4-bromophenyl)-2-(3-methylphenyl)ethyl]propan-1-amine
CID 60818106

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine?
The IUPAC name of N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine (CID 43495145) is N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine.
What is the SMILES notation for N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine?
The canonical SMILES for N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine is CCCNC(Cc1ccccc1)c1ccc(C)cc1.
What is the InChIKey of N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine?
The InChIKey is AYWRGXQJDADARJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-3-13-19-18(14-16-7-5-4-6-8-16)17-11-9-15(2)10-12-17/h4-12,18-19H,3,13-14H2,1-2H3.
What are the key properties of N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine?
N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine has a molecular weight of 253.39 g/mol, XLogP of 4.28, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine is sourced from PubChem (CID 43495145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).