2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine

C12H19NO2 — CID 117299291

IUPAC2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine
SMILESCOCc1ccc(OC)c(C(C)(C)N)c1
InChIInChI=1S/C12H19NO2/c1-12(2,13)10-7-9(8-14-3)5-6-11(10)15-4/h5-7H,8,13H2,1-4H3
InChIKeyBIZNEAWJNVPMQJ-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.04
Rot. Bonds4

About 2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine

2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine (PubChem CID 117299291) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine.

Molecular Properties

Compound Name2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine
PubChem CID117299291
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine
SMILESCOCc1ccc(OC)c(C(C)(C)N)c1
InChIInChI=1S/C12H19NO2/c1-12(2,13)10-7-9(8-14-3)5-6-11(10)15-4/h5-7H,8,13H2,1-4H3
InChIKeyBIZNEAWJNVPMQJ-UHFFFAOYSA-N
XLogP2.04
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-ol
CID 117300505
O-[[2-methoxy-5-(methoxymethyl)phenyl]methyl]hydroxylamine
CID 117286953
2-(2-methoxy-5-methylsulfanylphenyl)propan-2-amine
CID 117302166
2-(2-methoxy-5-pentan-3-ylphenyl)propan-2-amine
CID 117343688
2-(2,4,5-trimethoxyphenyl)propan-2-amine
CID 15102791
2-methoxy-4-(methoxymethyl)-1-methylbenzene
CID 91136887
O-[2-[3-(1,1-difluoroethyl)-4-methoxyphenyl]ethyl]hydroxylamine
CID 117333808
2-[2-methoxy-5-(methoxymethyl)phenyl]propan-1-amine
CID 83884513
2-[2-amino-4-(methoxymethyl)phenoxy]-5-(methoxymethyl)aniline
CID 174463827
2-[3-(1,1-difluoroethyl)-4-methoxyphenyl]ethanamine
CID 84681003
1,2-dimethoxy-4-(methoxymethyl)benzene;sulfuryl dichloride
CID 87637876
N'-hydroxy-2-methoxy-5-(methoxymethyl)benzenecarboximidamide
CID 77066179

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine?
The IUPAC name of 2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine (CID 117299291) is 2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine.
What is the SMILES notation for 2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine?
The canonical SMILES for 2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine is COCc1ccc(OC)c(C(C)(C)N)c1.
What is the InChIKey of 2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine?
The InChIKey is BIZNEAWJNVPMQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-12(2,13)10-7-9(8-14-3)5-6-11(10)15-4/h5-7H,8,13H2,1-4H3.
What are the key properties of 2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine?
2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine has a molecular weight of 209.29 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-amine is sourced from PubChem (CID 117299291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).