N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine

C15H24N2O2 — CID 115118959

IUPACN-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine
SMILESCOc1cc(C)c(CN(C)C2CCNC2)c(OC)c1
InChIInChI=1S/C15H24N2O2/c1-11-7-13(18-3)8-15(19-4)14(11)10-17(2)12-5-6-16-9-12/h7-8,12,16H,5-6,9-10H2,1-4H3
InChIKeyQEJYVNWOJHFNNN-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.81
Rot. Bonds5

About N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine

N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine (PubChem CID 115118959) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine
PubChem CID115118959
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine
SMILESCOc1cc(C)c(CN(C)C2CCNC2)c(OC)c1
InChIInChI=1S/C15H24N2O2/c1-11-7-13(18-3)8-15(19-4)14(11)10-17(2)12-5-6-16-9-12/h7-8,12,16H,5-6,9-10H2,1-4H3
InChIKeyQEJYVNWOJHFNNN-UHFFFAOYSA-N
XLogP1.81
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2,4-dimethoxyphenyl)methyl]-N-methylpyrrolidin-3-amine
CID 55172188
N-(2,4-dimethoxy-6-methylphenyl)-N-methylpyrrolidin-3-amine
CID 115118772
N-methyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine
CID 115118911
N-[(4-methoxy-3,5-dimethylphenyl)methyl]-N-methylpyrrolidin-3-amine
CID 115118960
N-[(2,4-dimethoxy-6-methylphenyl)methyl]-1-pyrrolidin-3-ylmethanamine
CID 115208846
N-[(5-bromo-2-methoxyphenyl)methyl]-N-methylpyrrolidin-3-amine
CID 63297828
2-methoxy-4-[[methyl(pyrrolidin-3-yl)amino]methyl]phenol
CID 63297913
2-bromo-6-methoxy-4-[[methyl(pyrrolidin-3-yl)amino]methyl]phenol
CID 55172189
2,4-dimethoxy-N-methyl-N-pyrrolidin-3-ylbenzenesulfonamide
CID 63298346
N-[(3-ethyl-4-methoxyphenyl)methyl]-N-methylpyrrolidin-3-amine
CID 115118917
N-methyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine
CID 55085534
2-[(2,4-dimethoxy-6-methylphenyl)methyl-methylamino]ethanethiol
CID 115224150

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine?
The IUPAC name of N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine (CID 115118959) is N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine.
What is the SMILES notation for N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine?
The canonical SMILES for N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine is COc1cc(C)c(CN(C)C2CCNC2)c(OC)c1.
What is the InChIKey of N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine?
The InChIKey is QEJYVNWOJHFNNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11-7-13(18-3)8-15(19-4)14(11)10-17(2)12-5-6-16-9-12/h7-8,12,16H,5-6,9-10H2,1-4H3.
What are the key properties of N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine?
N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine has a molecular weight of 264.37 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethoxy-6-methylphenyl)methyl]-N-methylpyrrolidin-3-amine is sourced from PubChem (CID 115118959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).