2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine

C15H25NO3 — CID 64865802

IUPAC2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine
SMILESCOc1ccc(CCNC(C)(C)C)c(OC)c1OC
InChIInChI=1S/C15H25NO3/c1-15(2,3)16-10-9-11-7-8-12(17-4)14(19-6)13(11)18-5/h7-8,16H,9-10H2,1-6H3
InChIKeyWINLHEAOHTWXIZ-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.64
Rot. Bonds6

About 2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine

2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine (PubChem CID 64865802) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine
PubChem CID64865802
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine
SMILESCOc1ccc(CCNC(C)(C)C)c(OC)c1OC
InChIInChI=1S/C15H25NO3/c1-15(2,3)16-10-9-11-7-8-12(17-4)14(19-6)13(11)18-5/h7-8,16H,9-10H2,1-6H3
InChIKeyWINLHEAOHTWXIZ-UHFFFAOYSA-N
XLogP2.64
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,3-dimethyl-5-(2,3,4-trimethoxyphenyl)pentan-1-amine
CID 65305448
3-(2,3,4-trimethoxyphenyl)propan-1-ol
CID 11790895
N-tert-butyl-2-[[N'-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]carbamimidoyl]amino]acetamide
CID 111384699
N-[2-(2-methoxy-5-nitrophenyl)ethyl]-2-methylpropan-2-amine
CID 62548144
N'-[(2,3,4-trimethoxyphenyl)methyl]-N-[2-[(2,3,4-trimethoxyphenyl)methylamino]ethyl]ethane-1,2-diamine;trihydrochloride
CID 139593123
trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane
CID 174513383
N'-tert-butyl-N-(2,5-dimethoxyphenyl)ethane-1,2-diamine
CID 54807795
2-methyl-1-(2-methyl-2-methylsulfanylpropyl)-3-[2-(2,3,4-trimethoxyphenyl)ethyl]guanidine;hydroiodide
CID 111610257
N-[2-[2-(2,3,4-trimethoxyphenyl)ethoxy]ethyl]propan-1-amine
CID 65302821
2-[2-(4-methoxy-2,3-dimethylphenyl)ethylamino]-2-methylpropanoic acid
CID 115128091
1-(4-tert-butylphenyl)-N-[2-(2,3,4-trimethoxyphenyl)ethyl]cyclopropane-1-carboxamide
CID 86885316
N-(2-amino-2-methylpropyl)-3-(2,3,4-trimethoxyphenyl)propanamide;hydrochloride
CID 119630582

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine (CID 64865802) is 2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine is COc1ccc(CCNC(C)(C)C)c(OC)c1OC.
What is the InChIKey of 2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine?
The InChIKey is WINLHEAOHTWXIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-15(2,3)16-10-9-11-7-8-12(17-4)14(19-6)13(11)18-5/h7-8,16H,9-10H2,1-6H3.
What are the key properties of 2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine?
2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine has a molecular weight of 267.37 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine is sourced from PubChem (CID 64865802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).