2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline

C17H24N2 — CID 62474954

IUPAC2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline
SMILESCc1cc(C)c(NCc2cc(C)n(C)c2C)c(C)c1
InChIInChI=1S/C17H24N2/c1-11-7-12(2)17(13(3)8-11)18-10-16-9-14(4)19(6)15(16)5/h7-9,18H,10H2,1-6H3
InChIKeyRMZKCRNZTXGIJB-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.18
Rot. Bonds3

About 2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline

2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline (PubChem CID 62474954) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline.

Molecular Properties

Compound Name2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline
PubChem CID62474954
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline
SMILESCc1cc(C)c(NCc2cc(C)n(C)c2C)c(C)c1
InChIInChI=1S/C17H24N2/c1-11-7-12(2)17(13(3)8-11)18-10-16-9-14(4)19(6)15(16)5/h7-9,18H,10H2,1-6H3
InChIKeyRMZKCRNZTXGIJB-UHFFFAOYSA-N
XLogP4.18
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,5-dimethyl-4-[(2,4,6-trimethylanilino)methyl]pyrrole-2-carbonitrile
CID 115977096
2-ethyl-6-methyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline
CID 62475131
N-[(1,5-dimethylpyrazol-4-yl)methyl]-2,4,6-trimethylaniline
CID 79579160
2-chloro-4,6-difluoro-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline
CID 83081475
4-fluoro-2-methyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline
CID 55080855
3-N,3-N,4-trimethyl-1-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]benzene-1,3-diamine
CID 115376878
1-(2,4-dimethylphenyl)-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]ethanamine
CID 62472782
2-methyl-1-[(1,2,5-trimethylpyrrol-3-yl)methylamino]butan-2-ol
CID 65108522
[4-[(1,2,5-trimethylpyrrol-3-yl)methylamino]phenyl]methanol
CID 113397661
methyl 2-methyl-2-[(1,2,5-trimethylpyrrol-3-yl)methylamino]propanoate
CID 62474581
2,3,5-trifluoro-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline
CID 55118875
N-[(2,3-dimethylphenyl)methyl]-2,4,6-trimethylaniline
CID 55191577

Frequently Asked Questions

What is the IUPAC name of 2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline?
The IUPAC name of 2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline (CID 62474954) is 2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline.
What is the SMILES notation for 2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline?
The canonical SMILES for 2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline is Cc1cc(C)c(NCc2cc(C)n(C)c2C)c(C)c1.
What is the InChIKey of 2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline?
The InChIKey is RMZKCRNZTXGIJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-11-7-12(2)17(13(3)8-11)18-10-16-9-14(4)19(6)15(16)5/h7-9,18H,10H2,1-6H3.
What are the key properties of 2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline?
2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline has a molecular weight of 256.39 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-trimethyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline is sourced from PubChem (CID 62474954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).