2-propan-2-ylidenepyrrolidine

C7H13N — CID 58322007

IUPAC2-propan-2-ylidenepyrrolidine
SMILESCC(C)=C1CCCN1
InChIInChI=1S/C7H13N/c1-6(2)7-4-3-5-8-7/h8H,3-5H2,1-2H3
InChIKeyWMTZEPPZHJWADL-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.66
Rot. Bonds

About 2-propan-2-ylidenepyrrolidine

2-propan-2-ylidenepyrrolidine (PubChem CID 58322007) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is 2-propan-2-ylidenepyrrolidine.

Molecular Properties

Compound Name2-propan-2-ylidenepyrrolidine
PubChem CID58322007
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC Name2-propan-2-ylidenepyrrolidine
SMILESCC(C)=C1CCCN1
InChIInChI=1S/C7H13N/c1-6(2)7-4-3-5-8-7/h8H,3-5H2,1-2H3
InChIKeyWMTZEPPZHJWADL-UHFFFAOYSA-N
XLogP1.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Dimethylpyrroline
CID 21129173
5,6-Dimethyltetrahydropyridine
CID 22901330
2-(1,1,1-Trifluoropropan-2-ylidene)pyrrolidine
CID 175689515
2,3-Di(propan-2-ylidene)pyrrolidine
CID 57564408
(4R)-2-methylidene-4-(2-methylprop-1-enyl)pyrrolidine
CID 68009516
4,5-diethyl-2,3-dihydro-1H-pyrrole
CID 68168306
4-methyl-5-propan-2-yl-2,3-dihydro-1H-pyrrole
CID 68250927
2-Propylidenepyrrolidine
CID 68860898
4-ethyl-5-propyl-2,3-dihydro-1H-pyrrole
CID 70237101
2-Ethylidenepyrrolidine
CID 70551220
3-(Propan-2-ylidene)pyrrolidine
CID 79875563
2,4,5-trimethyl-2,3-dihydro-1H-pyrrole
CID 89019001

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-ylidenepyrrolidine?
The IUPAC name of 2-propan-2-ylidenepyrrolidine (CID 58322007) is 2-propan-2-ylidenepyrrolidine.
What is the SMILES notation for 2-propan-2-ylidenepyrrolidine?
The canonical SMILES for 2-propan-2-ylidenepyrrolidine is CC(C)=C1CCCN1.
What is the InChIKey of 2-propan-2-ylidenepyrrolidine?
The InChIKey is WMTZEPPZHJWADL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c1-6(2)7-4-3-5-8-7/h8H,3-5H2,1-2H3.
What are the key properties of 2-propan-2-ylidenepyrrolidine?
2-propan-2-ylidenepyrrolidine has a molecular weight of 111.19 g/mol, XLogP of 1.66, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-ylidenepyrrolidine is sourced from PubChem (CID 58322007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).