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

C11H16N2 — CID 160735393

IUPAC5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole
SMILESC1=C(C2CCNC2)C(C2CC2)=NC1
InChIInChI=1S/C11H16N2/c1-2-8(1)11-10(4-6-13-11)9-3-5-12-7-9/h4,8-9,12H,1-3,5-7H2
InChIKeyRUWNCRMTXIQRIL-UHFFFAOYSA-N
MW176.26 g/mol
LogP1.39
Rot. Bonds2

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

5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole (PubChem CID 160735393) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole.

Molecular Properties

Compound Name5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole
PubChem CID160735393
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole
SMILESC1=C(C2CCNC2)C(C2CC2)=NC1
InChIInChI=1S/C11H16N2/c1-2-8(1)11-10(4-6-13-11)9-3-5-12-7-9/h4,8-9,12H,1-3,5-7H2
InChIKeyRUWNCRMTXIQRIL-UHFFFAOYSA-N
XLogP1.39
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-6-[[(3R)-pyrrolidin-3-yl]methyl]-2,3-dihydropyridin-2-amine
CID 89037011
2-pyrrolidin-2-yl-3a,7a-dihydro-3H-indole
CID 90710165
N-methyl-1-(6-methyl-2-azabicyclo[3.1.0]hexan-3-yl)but-2-en-1-imine
CID 123604432
2-[(2S)-pyrrolidin-2-yl]-3a,7a-dihydro-3H-indole
CID 123606898
4-ethylidene-N,5-dimethyl-5-propan-2-ylpyrrolidin-3-imine
CID 123614076
2,6-Dimethyl-4-(pyrrolidin-3-ylmethyl)-2,3-dihydropyridine
CID 135135116
5-(1-methylcyclopropyl)-4-pyrrolidin-3-yl-2H-pyrrole
CID 157710250
5-methyl-4-pyrrolidin-3-yl-2H-pyrrole
CID 158880750
3,5-dimethyl-4-pyrrolidin-3-yl-2H-pyrrole
CID 159697912
11-(Cyclopropylmethyl)-10-methyl-2,9-diazatricyclo[6.3.1.04,12]dodeca-4,6,8-triene
CID 163454198
7,8-Bis(3-methylidenepent-4-enyl)-1,2,3,3a,4,5-hexahydropyrrolo[3,4-e]indole
CID 176088923
(Z)-3-(2-azabicyclo[2.2.1]hept-5-en-6-yl)-N-ethylpent-3-en-2-imine;ethane
CID 177350749

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole?
The IUPAC name of 5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole (CID 160735393) is 5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole.
What is the SMILES notation for 5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole?
The canonical SMILES for 5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole is C1=C(C2CCNC2)C(C2CC2)=NC1.
What is the InChIKey of 5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole?
The InChIKey is RUWNCRMTXIQRIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-2-8(1)11-10(4-6-13-11)9-3-5-12-7-9/h4,8-9,12H,1-3,5-7H2.
What are the key properties of 5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole?
5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole has a molecular weight of 176.26 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-4-pyrrolidin-3-yl-2H-pyrrole is sourced from PubChem (CID 160735393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).