4,4-dimethyl-1-prop-2-enylpiperidine

C10H19N — CID 18722910

IUPAC4,4-dimethyl-1-prop-2-enylpiperidine
SMILESC=CCN1CCC(C)(C)CC1
InChIInChI=1S/C10H19N/c1-4-7-11-8-5-10(2,3)6-9-11/h4H,1,5-9H2,2-3H3
InChIKeyHDHGDRZMEOSXRI-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.29
Rot. Bonds2

About 4,4-dimethyl-1-prop-2-enylpiperidine

4,4-dimethyl-1-prop-2-enylpiperidine (PubChem CID 18722910) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 4,4-dimethyl-1-prop-2-enylpiperidine.

Molecular Properties

Compound Name4,4-dimethyl-1-prop-2-enylpiperidine
PubChem CID18722910
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name4,4-dimethyl-1-prop-2-enylpiperidine
SMILESC=CCN1CCC(C)(C)CC1
InChIInChI=1S/C10H19N/c1-4-7-11-8-5-10(2,3)6-9-11/h4H,1,5-9H2,2-3H3
InChIKeyHDHGDRZMEOSXRI-UHFFFAOYSA-N
XLogP2.29
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-1-prop-2-enylpiperidine?
The IUPAC name of 4,4-dimethyl-1-prop-2-enylpiperidine (CID 18722910) is 4,4-dimethyl-1-prop-2-enylpiperidine.
What is the SMILES notation for 4,4-dimethyl-1-prop-2-enylpiperidine?
The canonical SMILES for 4,4-dimethyl-1-prop-2-enylpiperidine is C=CCN1CCC(C)(C)CC1.
What is the InChIKey of 4,4-dimethyl-1-prop-2-enylpiperidine?
The InChIKey is HDHGDRZMEOSXRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-4-7-11-8-5-10(2,3)6-9-11/h4H,1,5-9H2,2-3H3.
What are the key properties of 4,4-dimethyl-1-prop-2-enylpiperidine?
4,4-dimethyl-1-prop-2-enylpiperidine has a molecular weight of 153.27 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-1-prop-2-enylpiperidine is sourced from PubChem (CID 18722910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).