1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine

C19H24ClN — CID 60817944

IUPAC1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine
SMILESCCCNC(Cc1cccc(Cl)c1)Cc1ccccc1C
InChIInChI=1S/C19H24ClN/c1-3-11-21-19(13-16-8-6-10-18(20)12-16)14-17-9-5-4-7-15(17)2/h4-10,12,19,21H,3,11,13-14H2,1-2H3
InChIKeyFTLWWULYOYLRJY-UHFFFAOYSA-N
MW301.86 g/mol
LogP4.80
Rot. Bonds7

About 1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine

1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine (PubChem CID 60817944) has the molecular formula C19H24ClN and a molecular weight of 301.86 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine.

Molecular Properties

Compound Name1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine
PubChem CID60817944
Molecular FormulaC19H24ClN
Molecular Weight301.86 g/mol
Exact Mass301.16
IUPAC Name1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine
SMILESCCCNC(Cc1cccc(Cl)c1)Cc1ccccc1C
InChIInChI=1S/C19H24ClN/c1-3-11-21-19(13-16-8-6-10-18(20)12-16)14-17-9-5-4-7-15(17)2/h4-10,12,19,21H,3,11,13-14H2,1-2H3
InChIKeyFTLWWULYOYLRJY-UHFFFAOYSA-N
XLogP4.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.86
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-chlorophenyl)-N-ethyl-3-(5-fluoro-2-methylphenyl)propan-2-amine
CID 105373667
1-(3-chlorophenyl)-3-methylsulfanyl-N-propylpropan-2-amine
CID 62691555
N-[1-(3-chlorophenyl)-2-(2-methylphenyl)ethyl]propan-1-amine
CID 60819521
1-(3-chlorophenyl)-6-methyl-N-propylheptan-2-amine
CID 83162303
N-[2-(3-chlorophenyl)ethyl]-1-(2-methylphenyl)propan-2-amine
CID 57156795
1-(3-chlorophenyl)-5,5-dimethyl-N-propylhexan-2-amine
CID 55187933
1-(3-chlorophenyl)-N-propylhex-5-yn-2-amine
CID 55247955
1-(3-chlorophenyl)-4-methylidene-N-propylhexan-2-amine
CID 66046965
1-chloro-3-[2-(chloromethyl)-3-(2-methylphenyl)propyl]benzene
CID 66048137
1-(3-chlorophenyl)-N-propyl-3-(1,3-thiazol-2-yl)propan-2-amine
CID 79823913
1-butan-2-ylsulfanyl-3-(3-chlorophenyl)-N-propylpropan-2-amine
CID 65136450
1-(3-chlorophenyl)-3-(1,3-dioxolan-2-yl)-N-propylpropan-2-amine
CID 103546384

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine?
The IUPAC name of 1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine (CID 60817944) is 1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine.
What is the SMILES notation for 1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine?
The canonical SMILES for 1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine is CCCNC(Cc1cccc(Cl)c1)Cc1ccccc1C.
What is the InChIKey of 1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine?
The InChIKey is FTLWWULYOYLRJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24ClN/c1-3-11-21-19(13-16-8-6-10-18(20)12-16)14-17-9-5-4-7-15(17)2/h4-10,12,19,21H,3,11,13-14H2,1-2H3.
What are the key properties of 1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine?
1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine has a molecular weight of 301.86 g/mol, XLogP of 4.80, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-3-(2-methylphenyl)-N-propylpropan-2-amine is sourced from PubChem (CID 60817944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).