2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine

C20H27N — CID 3845327

IUPAC2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine
SMILESCC(C)C(NC(c1ccccc1)C(C)C)c1ccccc1
InChIInChI=1S/C20H27N/c1-15(2)19(17-11-7-5-8-12-17)21-20(16(3)4)18-13-9-6-10-14-18/h5-16,19-21H,1-4H3
InChIKeyUJKCCDIQRNMCBI-UHFFFAOYSA-N
MW281.44 g/mol
LogP5.37
Rot. Bonds6

About 2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine

2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine (PubChem CID 3845327) has the molecular formula C20H27N and a molecular weight of 281.44 g/mol. Its IUPAC name is 2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine
PubChem CID3845327
Molecular FormulaC20H27N
Molecular Weight281.44 g/mol
Exact Mass281.21
IUPAC Name2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine
SMILESCC(C)C(NC(c1ccccc1)C(C)C)c1ccccc1
InChIInChI=1S/C20H27N/c1-15(2)19(17-11-7-5-8-12-17)21-20(16(3)4)18-13-9-6-10-14-18/h5-16,19-21H,1-4H3
InChIKeyUJKCCDIQRNMCBI-UHFFFAOYSA-N
XLogP5.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.44
LogP ≤ 55.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,3-dimethyl-N-(2-methyl-1-phenylpropyl)butan-2-amine
CID 113457713
N-(1,1-difluoropropan-2-yl)-2-methyl-1-phenylpropan-1-amine
CID 102868420
N-but-3-en-2-yl-2-methyl-1-phenylpropan-1-amine
CID 115591753
(2S)-2-[(2-methyl-1-phenylpropyl)amino]-2-phenylethanol
CID 107862261
(2R)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]propanamide
CID 9132466
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-methyl-1-phenylpropan-1-amine
CID 81353330
(2S)-2-[[(1S)-2-methyl-1-phenylpropyl]amino]propanamide
CID 9132458
2-methyl-1-phenyl-N-(1-pyridin-4-ylethyl)propan-1-amine
CID 43685407
N-[(1R)-1-(2-bromophenyl)ethyl]-2-methyl-1-phenylpropan-1-amine
CID 81383697
N-[(1S)-1-(2-bromophenyl)ethyl]-2-methyl-1-phenylpropan-1-amine
CID 81383104
(2R)-2-[(2-methyl-1-phenylpropyl)amino]butan-1-ol
CID 103922515
2-methyl-1-phenyl-N-[(1R)-1-thiophen-2-ylethyl]propan-1-amine
CID 81398198

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine?
The IUPAC name of 2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine (CID 3845327) is 2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine.
What is the SMILES notation for 2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine?
The canonical SMILES for 2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine is CC(C)C(NC(c1ccccc1)C(C)C)c1ccccc1.
What is the InChIKey of 2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine?
The InChIKey is UJKCCDIQRNMCBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N/c1-15(2)19(17-11-7-5-8-12-17)21-20(16(3)4)18-13-9-6-10-14-18/h5-16,19-21H,1-4H3.
What are the key properties of 2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine?
2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine has a molecular weight of 281.44 g/mol, XLogP of 5.37, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methyl-1-phenylpropyl)-1-phenylpropan-1-amine is sourced from PubChem (CID 3845327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).