3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole

C10H17N — CID 126733586

IUPAC3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole
SMILESC=C1N=C(C(C)C)C(C)C1C
InChIInChI=1S/C10H17N/c1-6(2)10-8(4)7(3)9(5)11-10/h6-8H,5H2,1-4H3
InChIKeyFFWWYTQMISYRCI-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.88
Rot. Bonds1

About 3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole

3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole (PubChem CID 126733586) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole.

Molecular Properties

Compound Name3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole
PubChem CID126733586
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole
SMILESC=C1N=C(C(C)C)C(C)C1C
InChIInChI=1S/C10H17N/c1-6(2)10-8(4)7(3)9(5)11-10/h6-8H,5H2,1-4H3
InChIKeyFFWWYTQMISYRCI-UHFFFAOYSA-N
XLogP2.88
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole?
The IUPAC name of 3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole (CID 126733586) is 3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole.
What is the SMILES notation for 3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole?
The canonical SMILES for 3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole is C=C1N=C(C(C)C)C(C)C1C.
What is the InChIKey of 3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole?
The InChIKey is FFWWYTQMISYRCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-6(2)10-8(4)7(3)9(5)11-10/h6-8H,5H2,1-4H3.
What are the key properties of 3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole?
3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole has a molecular weight of 151.25 g/mol, XLogP of 2.88, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-2-methylidene-5-propan-2-yl-3,4-dihydropyrrole is sourced from PubChem (CID 126733586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).