1-propan-2-yl-4-propan-2-ylidenepiperidine

C11H21N — CID 58355811

IUPAC1-propan-2-yl-4-propan-2-ylidenepiperidine
SMILESCC(C)=C1CCN(C(C)C)CC1
InChIInChI=1S/C11H21N/c1-9(2)11-5-7-12(8-6-11)10(3)4/h10H,5-8H2,1-4H3
InChIKeyCNVLQXHVTMPYQN-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.83
Rot. Bonds1

About 1-propan-2-yl-4-propan-2-ylidenepiperidine

1-propan-2-yl-4-propan-2-ylidenepiperidine (PubChem CID 58355811) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 1-propan-2-yl-4-propan-2-ylidenepiperidine.

Molecular Properties

Compound Name1-propan-2-yl-4-propan-2-ylidenepiperidine
PubChem CID58355811
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name1-propan-2-yl-4-propan-2-ylidenepiperidine
SMILESCC(C)=C1CCN(C(C)C)CC1
InChIInChI=1S/C11H21N/c1-9(2)11-5-7-12(8-6-11)10(3)4/h10H,5-8H2,1-4H3
InChIKeyCNVLQXHVTMPYQN-UHFFFAOYSA-N
XLogP2.83
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

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1-(1-propan-2-yl-3,6-dihydro-2H-pyridin-4-yl)ethanone
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ethane;1-propan-2-ylpyrrolidine
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1,4-di(propan-2-yl)piperidine
CID 21303253
ethane;1-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 177135939
1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine
CID 158767420
formaldehyde;1-methyl-4-propan-2-ylpiperazine
CID 157498732
1-propan-2-ylpiperidine;hydrobromide
CID 44887258
1,4-dimethyl-7-propan-2-yl-1,4,7-triazonane
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ethane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
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1-methyl-4-propan-2-ylpiperazine
CID 7471963

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-4-propan-2-ylidenepiperidine?
The IUPAC name of 1-propan-2-yl-4-propan-2-ylidenepiperidine (CID 58355811) is 1-propan-2-yl-4-propan-2-ylidenepiperidine.
What is the SMILES notation for 1-propan-2-yl-4-propan-2-ylidenepiperidine?
The canonical SMILES for 1-propan-2-yl-4-propan-2-ylidenepiperidine is CC(C)=C1CCN(C(C)C)CC1.
What is the InChIKey of 1-propan-2-yl-4-propan-2-ylidenepiperidine?
The InChIKey is CNVLQXHVTMPYQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-9(2)11-5-7-12(8-6-11)10(3)4/h10H,5-8H2,1-4H3.
What are the key properties of 1-propan-2-yl-4-propan-2-ylidenepiperidine?
1-propan-2-yl-4-propan-2-ylidenepiperidine has a molecular weight of 167.30 g/mol, XLogP of 2.83, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-4-propan-2-ylidenepiperidine is sourced from PubChem (CID 58355811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).