1,1-diphenyl-3-propan-2-yloxypropan-2-amine

C18H23NO — CID 79574233

IUPAC1,1-diphenyl-3-propan-2-yloxypropan-2-amine
SMILESCC(C)OCC(N)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H23NO/c1-14(2)20-13-17(19)18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,14,17-18H,13,19H2,1-2H3
InChIKeyWERMVSBXYBVEGN-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.57
Rot. Bonds6

About 1,1-diphenyl-3-propan-2-yloxypropan-2-amine

1,1-diphenyl-3-propan-2-yloxypropan-2-amine (PubChem CID 79574233) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 1,1-diphenyl-3-propan-2-yloxypropan-2-amine.

Molecular Properties

Compound Name1,1-diphenyl-3-propan-2-yloxypropan-2-amine
PubChem CID79574233
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name1,1-diphenyl-3-propan-2-yloxypropan-2-amine
SMILESCC(C)OCC(N)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H23NO/c1-14(2)20-13-17(19)18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,14,17-18H,13,19H2,1-2H3
InChIKeyWERMVSBXYBVEGN-UHFFFAOYSA-N
XLogP3.57
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(2S)-1-propan-2-yloxypropan-2-yl]benzene
CID 157034832
3,3-diphenylpropane-1,2-diamine;dihydrochloride
CID 141351446
2-methyl-6,6-diphenylhexane-1,5-diamine
CID 174986807
(1R)-2-methoxy-1-phenylethanamine
CID 11019045
2-methyl-1-phenyl-4-propan-2-yloxybutan-1-amine
CID 104845224
4-methyl-1,1-diphenylheptan-2-amine
CID 63412141
2-methyl-1,1-diphenylhexan-3-amine
CID 83047736
(2S,3S)-3-methyl-4,4-diphenylbutan-2-amine
CID 59951948
1-phenyl-2-(2-propan-2-yloxyethoxy)butan-1-amine
CID 43211618
1-phenyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
CID 66275435
2-propan-2-yloxy-1-(4-propan-2-ylphenyl)ethanamine
CID 43184569
1,1-diphenylhexan-2-amine;hydrate
CID 173442178

Frequently Asked Questions

What is the IUPAC name of 1,1-diphenyl-3-propan-2-yloxypropan-2-amine?
The IUPAC name of 1,1-diphenyl-3-propan-2-yloxypropan-2-amine (CID 79574233) is 1,1-diphenyl-3-propan-2-yloxypropan-2-amine.
What is the SMILES notation for 1,1-diphenyl-3-propan-2-yloxypropan-2-amine?
The canonical SMILES for 1,1-diphenyl-3-propan-2-yloxypropan-2-amine is CC(C)OCC(N)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 1,1-diphenyl-3-propan-2-yloxypropan-2-amine?
The InChIKey is WERMVSBXYBVEGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-14(2)20-13-17(19)18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,14,17-18H,13,19H2,1-2H3.
What are the key properties of 1,1-diphenyl-3-propan-2-yloxypropan-2-amine?
1,1-diphenyl-3-propan-2-yloxypropan-2-amine has a molecular weight of 269.39 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diphenyl-3-propan-2-yloxypropan-2-amine is sourced from PubChem (CID 79574233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).