(2S)-1,4-dimethyl-2-prop-2-enylpiperidine

C10H19N — CID 174063231

IUPAC(2S)-1,4-dimethyl-2-prop-2-enylpiperidine
SMILESC=CC[C@H]1CC(C)CCN1C
InChIInChI=1S/C10H19N/c1-4-5-10-8-9(2)6-7-11(10)3/h4,9-10H,1,5-8H2,2-3H3/t9?,10-/m0/s1
InChIKeyIUYMCXSECBDLNX-AXDSSHIGSA-N
MW153.27 g/mol
LogP2.29
Rot. Bonds2

About (2S)-1,4-dimethyl-2-prop-2-enylpiperidine

(2S)-1,4-dimethyl-2-prop-2-enylpiperidine (PubChem CID 174063231) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is (2S)-1,4-dimethyl-2-prop-2-enylpiperidine.

Molecular Properties

Compound Name(2S)-1,4-dimethyl-2-prop-2-enylpiperidine
PubChem CID174063231
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name(2S)-1,4-dimethyl-2-prop-2-enylpiperidine
SMILESC=CC[C@H]1CC(C)CCN1C
InChIInChI=1S/C10H19N/c1-4-5-10-8-9(2)6-7-11(10)3/h4,9-10H,1,5-8H2,2-3H3/t9?,10-/m0/s1
InChIKeyIUYMCXSECBDLNX-AXDSSHIGSA-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 (2S)-1,4-dimethyl-2-prop-2-enylpiperidine?
The IUPAC name of (2S)-1,4-dimethyl-2-prop-2-enylpiperidine (CID 174063231) is (2S)-1,4-dimethyl-2-prop-2-enylpiperidine.
What is the SMILES notation for (2S)-1,4-dimethyl-2-prop-2-enylpiperidine?
The canonical SMILES for (2S)-1,4-dimethyl-2-prop-2-enylpiperidine is C=CC[C@H]1CC(C)CCN1C.
What is the InChIKey of (2S)-1,4-dimethyl-2-prop-2-enylpiperidine?
The InChIKey is IUYMCXSECBDLNX-AXDSSHIGSA-N. The full InChI is InChI=1S/C10H19N/c1-4-5-10-8-9(2)6-7-11(10)3/h4,9-10H,1,5-8H2,2-3H3/t9?,10-/m0/s1.
What are the key properties of (2S)-1,4-dimethyl-2-prop-2-enylpiperidine?
(2S)-1,4-dimethyl-2-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 (2S)-1,4-dimethyl-2-prop-2-enylpiperidine is sourced from PubChem (CID 174063231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).