N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine

C10H18N2 — CID 82490467

IUPACN-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine
SMILESCNCCc1cc(C)n(C)c1C
InChIInChI=1S/C10H18N2/c1-8-7-10(5-6-11-3)9(2)12(8)4/h7,11H,5-6H2,1-4H3
InChIKeyLZGFJEBNNJWCBG-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.40
Rot. Bonds3

About N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine

N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine (PubChem CID 82490467) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine
PubChem CID82490467
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC NameN-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine
SMILESCNCCc1cc(C)n(C)c1C
InChIInChI=1S/C10H18N2/c1-8-7-10(5-6-11-3)9(2)12(8)4/h7,11H,5-6H2,1-4H3
InChIKeyLZGFJEBNNJWCBG-UHFFFAOYSA-N
XLogP1.40
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-4-(1,2,5-trimethylpyrrol-3-yl)butan-1-amine
CID 96670635
N-[2-(1,2,5-trimethylpyrrol-3-yl)ethyl]propane-1-sulfonamide
CID 110641438
2,4,6-trimethyl-N-[2-(1,2,5-trimethylpyrrol-3-yl)ethyl]benzenesulfonamide
CID 110641451
2-(4-methoxyphenyl)-N-[2-(1,2,5-trimethylpyrrol-3-yl)ethyl]acetamide
CID 110415554
3-(2-fluorophenyl)-N-[2-(1,2,5-trimethylpyrrol-3-yl)ethyl]propanamide
CID 110791942
1-(4-chlorophenyl)-N-[2-(1,2,5-trimethylpyrrol-3-yl)ethyl]methanesulfonamide
CID 110415635
4-methyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]pentan-1-amine
CID 62473871
N-[(1,2,5-trimethylpyrrol-3-yl)methyl]butan-1-amine
CID 50850663
2-(5-tert-butyl-2-methylphenyl)-N-methylethanamine
CID 82126383
5-bromo-N-[2-(1,2,5-trimethylpyrrol-3-yl)ethyl]thiophene-2-sulfonamide
CID 110415650
3,5-dimethyl-N-[2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 110415649
N-[(1,2,5-trimethylpyrrol-3-yl)methyl]octan-1-amine
CID 113337043

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine?
The IUPAC name of N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine (CID 82490467) is N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine.
What is the SMILES notation for N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine?
The canonical SMILES for N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine is CNCCc1cc(C)n(C)c1C.
What is the InChIKey of N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine?
The InChIKey is LZGFJEBNNJWCBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-8-7-10(5-6-11-3)9(2)12(8)4/h7,11H,5-6H2,1-4H3.
What are the key properties of N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine?
N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine has a molecular weight of 166.27 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1,2,5-trimethylpyrrol-3-yl)ethanamine is sourced from PubChem (CID 82490467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).