(2R)-1-(3,5-dimethoxyphenyl)propan-2-amine

C11H17NO2 — CID 11052547

IUPAC(2R)-1-(3,5-dimethoxyphenyl)propan-2-amine
SMILESCOc1cc(C[C@@H](C)N)cc(OC)c1
InChIInChI=1S/C11H17NO2/c1-8(12)4-9-5-10(13-2)7-11(6-9)14-3/h5-8H,4,12H2,1-3H3/t8-/m1/s1
InChIKeyPDCLPGSYMZLLDX-MRVPVSSYSA-N
MW195.26 g/mol
LogP1.59
Rot. Bonds4

About (2R)-1-(3,5-dimethoxyphenyl)propan-2-amine

(2R)-1-(3,5-dimethoxyphenyl)propan-2-amine (PubChem CID 11052547) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is (2R)-1-(3,5-dimethoxyphenyl)propan-2-amine.

Molecular Properties

Compound Name(2R)-1-(3,5-dimethoxyphenyl)propan-2-amine
PubChem CID11052547
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name(2R)-1-(3,5-dimethoxyphenyl)propan-2-amine
SMILESCOc1cc(C[C@@H](C)N)cc(OC)c1
InChIInChI=1S/C11H17NO2/c1-8(12)4-9-5-10(13-2)7-11(6-9)14-3/h5-8H,4,12H2,1-3H3/t8-/m1/s1
InChIKeyPDCLPGSYMZLLDX-MRVPVSSYSA-N
XLogP1.59
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Mescaline
CID 4076
2,5-Dimethoxy-4-Methylamphetamine
CID 85875
2,5-Dimethoxy-4-iodoamphetamine
CID 1229
(+-)-2,5-Dimethoxyamphetamine
CID 62787
3-Methoxy-4,5-methylenedioxyamphetamine
CID 26175
2,4,5-Trimethoxyamphetamine
CID 31014
3,4,5-Trimethoxyamphetamine
CID 31016
3-Methoxyphenethylamine
CID 74866
Mescaline hydrochloride
CID 71580
4-Ethoxy-3,5-dimethoxybenzeneethanamine
CID 38240
2,5-Dimethoxy-4-ethylamphetamine
CID 27402
(+-)-3,4-Dimethoxyamphetamine
CID 8423

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(3,5-dimethoxyphenyl)propan-2-amine?
The IUPAC name of (2R)-1-(3,5-dimethoxyphenyl)propan-2-amine (CID 11052547) is (2R)-1-(3,5-dimethoxyphenyl)propan-2-amine.
What is the SMILES notation for (2R)-1-(3,5-dimethoxyphenyl)propan-2-amine?
The canonical SMILES for (2R)-1-(3,5-dimethoxyphenyl)propan-2-amine is COc1cc(C[C@@H](C)N)cc(OC)c1.
What is the InChIKey of (2R)-1-(3,5-dimethoxyphenyl)propan-2-amine?
The InChIKey is PDCLPGSYMZLLDX-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-8(12)4-9-5-10(13-2)7-11(6-9)14-3/h5-8H,4,12H2,1-3H3/t8-/m1/s1.
What are the key properties of (2R)-1-(3,5-dimethoxyphenyl)propan-2-amine?
(2R)-1-(3,5-dimethoxyphenyl)propan-2-amine has a molecular weight of 195.26 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(3,5-dimethoxyphenyl)propan-2-amine is sourced from PubChem (CID 11052547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).