1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine

C15H25N — CID 609397

IUPAC1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine
SMILESCC(C)=C1C=C(N2CCCC2)CC(C)(C)C1
InChIInChI=1S/C15H25N/c1-12(2)13-9-14(11-15(3,4)10-13)16-7-5-6-8-16/h9H,5-8,10-11H2,1-4H3
InChIKeySDEJIUYAABNSML-UHFFFAOYSA-N
MW219.37 g/mol
LogP4.12
Rot. Bonds1

About 1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine

1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine (PubChem CID 609397) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine.

Molecular Properties

Compound Name1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine
PubChem CID609397
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine
SMILESCC(C)=C1C=C(N2CCCC2)CC(C)(C)C1
InChIInChI=1S/C15H25N/c1-12(2)13-9-14(11-15(3,4)10-13)16-7-5-6-8-16/h9H,5-8,10-11H2,1-4H3
InChIKeySDEJIUYAABNSML-UHFFFAOYSA-N
XLogP4.12
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine?
The IUPAC name of 1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine (CID 609397) is 1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine.
What is the SMILES notation for 1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine?
The canonical SMILES for 1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine is CC(C)=C1C=C(N2CCCC2)CC(C)(C)C1.
What is the InChIKey of 1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine?
The InChIKey is SDEJIUYAABNSML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-12(2)13-9-14(11-15(3,4)10-13)16-7-5-6-8-16/h9H,5-8,10-11H2,1-4H3.
What are the key properties of 1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine?
1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine has a molecular weight of 219.37 g/mol, XLogP of 4.12, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,5-dimethyl-3-propan-2-ylidenecyclohexen-1-yl)pyrrolidine is sourced from PubChem (CID 609397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).