2-methoxy-2-methyl-1-phenylpropan-1-amine

C11H17NO — CID 76606196

IUPAC2-methoxy-2-methyl-1-phenylpropan-1-amine
SMILESCOC(C)(C)C(N)c1ccccc1
InChIInChI=1S/C11H17NO/c1-11(2,13-3)10(12)9-7-5-4-6-8-9/h4-8,10H,12H2,1-3H3
InChIKeyTWHLTZMRVCGXTQ-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.11
Rot. Bonds3

About 2-methoxy-2-methyl-1-phenylpropan-1-amine

2-methoxy-2-methyl-1-phenylpropan-1-amine (PubChem CID 76606196) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 2-methoxy-2-methyl-1-phenylpropan-1-amine.

Molecular Properties

Compound Name2-methoxy-2-methyl-1-phenylpropan-1-amine
PubChem CID76606196
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name2-methoxy-2-methyl-1-phenylpropan-1-amine
SMILESCOC(C)(C)C(N)c1ccccc1
InChIInChI=1S/C11H17NO/c1-11(2,13-3)10(12)9-7-5-4-6-8-9/h4-8,10H,12H2,1-3H3
InChIKeyTWHLTZMRVCGXTQ-UHFFFAOYSA-N
XLogP2.11
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-2-methyl-1-naphthalen-2-ylpropan-1-amine
CID 79197880
[(2S)-3-methoxy-3-methylbutan-2-yl]benzene
CID 67208370
3-methoxy-2,2-dimethyl-1-phenylpropan-1-amine
CID 121314723
2-methoxy-2-methyl-1-[3-(trifluoromethoxy)phenyl]propan-1-amine
CID 79197999
2-methoxy-2-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine
CID 79197654
methyl 3-amino-2,2-dimethyl-3-phenylpropanoate;hydrochloride
CID 14426986
cumene;2-methoxy-2-methylpropane
CID 68666509
N'-(1-methoxypropan-2-yl)-N',2,2-trimethyl-1-phenylpropane-1,3-diamine
CID 55163332
(1S)-1-amino-2-methyl-1-phenylpropan-2-ol;methyl (2S)-2-amino-2-phenylacetate
CID 159907951
2-methoxy-2-methyl-1-(5-methylthiophen-3-yl)propan-1-amine
CID 79198358
2,2-dimethyl-1-phenylbutane-1,4-diamine
CID 116934434
(2R,3R)-2,3-diamino-2-methyl-3-phenylpropanoic acid
CID 24999684

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methyl-1-phenylpropan-1-amine?
The IUPAC name of 2-methoxy-2-methyl-1-phenylpropan-1-amine (CID 76606196) is 2-methoxy-2-methyl-1-phenylpropan-1-amine.
What is the SMILES notation for 2-methoxy-2-methyl-1-phenylpropan-1-amine?
The canonical SMILES for 2-methoxy-2-methyl-1-phenylpropan-1-amine is COC(C)(C)C(N)c1ccccc1.
What is the InChIKey of 2-methoxy-2-methyl-1-phenylpropan-1-amine?
The InChIKey is TWHLTZMRVCGXTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-11(2,13-3)10(12)9-7-5-4-6-8-9/h4-8,10H,12H2,1-3H3.
What are the key properties of 2-methoxy-2-methyl-1-phenylpropan-1-amine?
2-methoxy-2-methyl-1-phenylpropan-1-amine has a molecular weight of 179.26 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyl-1-phenylpropan-1-amine is sourced from PubChem (CID 76606196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).