methyl(1-phenylpropan-2-yl)azanium

C10H16N+ — CID 5250834

IUPACmethyl(1-phenylpropan-2-yl)azanium
SMILESC[NH2+]C(C)Cc1ccccc1
InChIInChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/p+1
InChIKeyMYWUZJCMWCOHBA-UHFFFAOYSA-O
MW150.24 g/mol
LogP0.81
Rot. Bonds3

About methyl(1-phenylpropan-2-yl)azanium

methyl(1-phenylpropan-2-yl)azanium (PubChem CID 5250834) has the molecular formula C10H16N+ and a molecular weight of 150.24 g/mol. Its IUPAC name is methyl(1-phenylpropan-2-yl)azanium.

Molecular Properties

Compound Namemethyl(1-phenylpropan-2-yl)azanium
PubChem CID5250834
Molecular FormulaC10H16N+
Molecular Weight150.24 g/mol
Exact Mass150.13
IUPAC Namemethyl(1-phenylpropan-2-yl)azanium
SMILESC[NH2+]C(C)Cc1ccccc1
InChIInChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/p+1
InChIKeyMYWUZJCMWCOHBA-UHFFFAOYSA-O
XLogP0.81
TPSA16.61 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.24
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

(2-benzyl-3-methylbutyl)benzene
CID 22277918
ethane;2-methylpropylbenzene
CID 162200929
λ2-plumbane;1-phenylpropan-2-amine
CID 174896483
2,3-dimethylbutylbenzene
CID 12054035
[(2S)-2-ethyl-3-methylbutyl]benzene
CID 59911229
(2S,3S)-3-methyl-4-phenylbutan-2-ol
CID 11194521
azane;1-phenylpropan-2-amine
CID 67350534
2-(1-phenylpropan-2-yldiselanyl)propylbenzene
CID 10430842
[(2R)-1-phenylpropan-2-yl]benzene
CID 11138041
2-(1-phenylpropan-2-ylsulfanyl)propylbenzene
CID 54020094
benzyl-[(2S)-butan-2-yl]azanium
CID 2462862
hydrogen peroxide;1-phenylbutan-2-ylbenzene
CID 19777291

Frequently Asked Questions

What is the IUPAC name of methyl(1-phenylpropan-2-yl)azanium?
The IUPAC name of methyl(1-phenylpropan-2-yl)azanium (CID 5250834) is methyl(1-phenylpropan-2-yl)azanium.
What is the SMILES notation for methyl(1-phenylpropan-2-yl)azanium?
The canonical SMILES for methyl(1-phenylpropan-2-yl)azanium is C[NH2+]C(C)Cc1ccccc1.
What is the InChIKey of methyl(1-phenylpropan-2-yl)azanium?
The InChIKey is MYWUZJCMWCOHBA-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/p+1.
What are the key properties of methyl(1-phenylpropan-2-yl)azanium?
methyl(1-phenylpropan-2-yl)azanium has a molecular weight of 150.24 g/mol, XLogP of 0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(1-phenylpropan-2-yl)azanium is sourced from PubChem (CID 5250834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).