N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine

C16H28N4 — CID 79761283

IUPACN-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine
SMILESCNC(Cc1nccn1C)C1(N2CCCC2)CCCC1
InChIInChI=1S/C16H28N4/c1-17-14(13-15-18-9-12-19(15)2)16(7-3-4-8-16)20-10-5-6-11-20/h9,12,14,17H,3-8,10-11,13H2,1-2H3
InChIKeyROUGBQSCGNEANJ-UHFFFAOYSA-N
MW276.43 g/mol
LogP1.96
Rot. Bonds5

About N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine

N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine (PubChem CID 79761283) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine
PubChem CID79761283
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC NameN-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine
SMILESCNC(Cc1nccn1C)C1(N2CCCC2)CCCC1
InChIInChI=1S/C16H28N4/c1-17-14(13-15-18-9-12-19(15)2)16(7-3-4-8-16)20-10-5-6-11-20/h9,12,14,17H,3-8,10-11,13H2,1-2H3
InChIKeyROUGBQSCGNEANJ-UHFFFAOYSA-N
XLogP1.96
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-(1-methylimidazol-2-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine
CID 79751944
N-methyl-1-(1-methylcyclopentyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 105011656
[2-(2-methyl-1,2,4-triazol-3-yl)-1-(1-piperidin-1-ylcyclopentyl)ethyl]hydrazine
CID 105242962
N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine
CID 107049969
(1-methylimidazol-2-yl)-(1-pyrrolidin-1-ylcyclopentyl)methanol
CID 79057165
1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine
CID 107189965
1-(1-methylcyclopentyl)-2-(1-methylimidazol-2-yl)ethanol
CID 115820564
N,3-dimethyl-1-(1-methylimidazol-2-yl)-3-piperidin-1-ylbutan-2-amine
CID 79761018
2-methoxy-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine
CID 79568733
2-cyclopentyl-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine
CID 79058715
N-methyl-2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
CID 82869589
2-(3-bromophenyl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine
CID 79060381

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine?
The IUPAC name of N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine (CID 79761283) is N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine.
What is the SMILES notation for N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine?
The canonical SMILES for N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine is CNC(Cc1nccn1C)C1(N2CCCC2)CCCC1.
What is the InChIKey of N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine?
The InChIKey is ROUGBQSCGNEANJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-17-14(13-15-18-9-12-19(15)2)16(7-3-4-8-16)20-10-5-6-11-20/h9,12,14,17H,3-8,10-11,13H2,1-2H3.
What are the key properties of N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine?
N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine has a molecular weight of 276.43 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine is sourced from PubChem (CID 79761283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).