3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole

C8H15N3 — CID 163730614

IUPAC3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole
SMILESCN1C=CNC1C1CCCN1
InChIInChI=1S/C8H15N3/c1-11-6-5-10-8(11)7-3-2-4-9-7/h5-10H,2-4H2,1H3
InChIKeyKZFTYNYRBPPAOD-UHFFFAOYSA-N
MW153.23 g/mol
LogP0.07
Rot. Bonds1

About 3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole

3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole (PubChem CID 163730614) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole.

Molecular Properties

Compound Name3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole
PubChem CID163730614
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole
SMILESCN1C=CNC1C1CCCN1
InChIInChI=1S/C8H15N3/c1-11-6-5-10-8(11)7-3-2-4-9-7/h5-10H,2-4H2,1H3
InChIKeyKZFTYNYRBPPAOD-UHFFFAOYSA-N
XLogP0.07
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole?
The IUPAC name of 3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole (CID 163730614) is 3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole.
What is the SMILES notation for 3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole?
The canonical SMILES for 3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole is CN1C=CNC1C1CCCN1.
What is the InChIKey of 3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole?
The InChIKey is KZFTYNYRBPPAOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-11-6-5-10-8(11)7-3-2-4-9-7/h5-10H,2-4H2,1H3.
What are the key properties of 3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole?
3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole has a molecular weight of 153.23 g/mol, XLogP of 0.07, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-pyrrolidin-2-yl-1,2-dihydroimidazole is sourced from PubChem (CID 163730614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).