5-methyl-4-pyrrolidin-3-yl-2H-pyrrole

C9H14N2 — CID 158880750

IUPAC5-methyl-4-pyrrolidin-3-yl-2H-pyrrole
SMILESCC1=NCC=C1C1CCNC1
InChIInChI=1S/C9H14N2/c1-7-9(3-5-11-7)8-2-4-10-6-8/h3,8,10H,2,4-6H2,1H3
InChIKeyJCZQCVZZFCZAQO-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.00
Rot. Bonds1

About 5-methyl-4-pyrrolidin-3-yl-2H-pyrrole

5-methyl-4-pyrrolidin-3-yl-2H-pyrrole (PubChem CID 158880750) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 5-methyl-4-pyrrolidin-3-yl-2H-pyrrole.

Molecular Properties

Compound Name5-methyl-4-pyrrolidin-3-yl-2H-pyrrole
PubChem CID158880750
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name5-methyl-4-pyrrolidin-3-yl-2H-pyrrole
SMILESCC1=NCC=C1C1CCNC1
InChIInChI=1S/C9H14N2/c1-7-9(3-5-11-7)8-2-4-10-6-8/h3,8,10H,2,4-6H2,1H3
InChIKeyJCZQCVZZFCZAQO-UHFFFAOYSA-N
XLogP1.00
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Fluoro-6-methyl-4-(pyrrolidin-3-ylmethyl)-2,3-dihydropyridine
CID 135135096
5-fluoro-4-pyrrolidin-3-yl-2H-pyrrole
CID 157576932
4-pyrrolidin-3-yl-5-(trifluoromethyl)-2H-pyrrole
CID 162138827
4-methyl-6-[[(3R)-pyrrolidin-3-yl]methyl]-2,3-dihydropyridin-2-amine
CID 89037011
N'-methyl-N'-[[5-(2-methylpropyl)-2H-pyrrol-4-yl]methyl]ethane-1,2-diamine
CID 121442676
N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine
CID 123472772
4-ethylidene-N,5-dimethyl-5-propan-2-ylpyrrolidin-3-imine
CID 123614076
(E)-4-pyrrolidin-3-ylpent-3-en-2-imine
CID 123879311
2-Methyl-1-(1,2,3,6-tetrahydropyridin-5-yl)propan-1-imine
CID 131966479
2,6-Dimethyl-4-(pyrrolidin-3-ylmethyl)-2,3-dihydropyridine
CID 135135116
5-pyrrolidin-2-yl-2H-pyrrole
CID 142786755
4-pyrrolidin-3-yl-2H-pyrrole
CID 148981006

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-pyrrolidin-3-yl-2H-pyrrole?
The IUPAC name of 5-methyl-4-pyrrolidin-3-yl-2H-pyrrole (CID 158880750) is 5-methyl-4-pyrrolidin-3-yl-2H-pyrrole.
What is the SMILES notation for 5-methyl-4-pyrrolidin-3-yl-2H-pyrrole?
The canonical SMILES for 5-methyl-4-pyrrolidin-3-yl-2H-pyrrole is CC1=NCC=C1C1CCNC1.
What is the InChIKey of 5-methyl-4-pyrrolidin-3-yl-2H-pyrrole?
The InChIKey is JCZQCVZZFCZAQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-7-9(3-5-11-7)8-2-4-10-6-8/h3,8,10H,2,4-6H2,1H3.
What are the key properties of 5-methyl-4-pyrrolidin-3-yl-2H-pyrrole?
5-methyl-4-pyrrolidin-3-yl-2H-pyrrole has a molecular weight of 150.22 g/mol, XLogP of 1.00, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-pyrrolidin-3-yl-2H-pyrrole is sourced from PubChem (CID 158880750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).