1-methyl-4-methylidene-3-prop-2-enylpiperidine

C10H17N — CID 143402603

IUPAC1-methyl-4-methylidene-3-prop-2-enylpiperidine
SMILESC=CCC1CN(C)CCC1=C
InChIInChI=1S/C10H17N/c1-4-5-10-8-11(3)7-6-9(10)2/h4,10H,1-2,5-8H2,3H3
InChIKeyYVCLPGXFSWVHPS-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.07
Rot. Bonds2

About 1-methyl-4-methylidene-3-prop-2-enylpiperidine

1-methyl-4-methylidene-3-prop-2-enylpiperidine (PubChem CID 143402603) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 1-methyl-4-methylidene-3-prop-2-enylpiperidine.

Molecular Properties

Compound Name1-methyl-4-methylidene-3-prop-2-enylpiperidine
PubChem CID143402603
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name1-methyl-4-methylidene-3-prop-2-enylpiperidine
SMILESC=CCC1CN(C)CCC1=C
InChIInChI=1S/C10H17N/c1-4-5-10-8-11(3)7-6-9(10)2/h4,10H,1-2,5-8H2,3H3
InChIKeyYVCLPGXFSWVHPS-UHFFFAOYSA-N
XLogP2.07
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.07
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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Cambridge id 5410985
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1,3-Dimethyl-4-methylidenepiperidine
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(3S)-1-(2,2-dimethylpropyl)-3-fluoro-3-prop-2-enylpiperidine
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1-(3,7-Dimethyl-6-octen-1-yl)-4-methylpiperazine
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4-Ethenyl-1-methylpiperidine
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1-(6-Prop-1-en-2-ylcyclohex-2-en-1-yl)piperidine
CID 12485229
4-Cyclopenta-1,3-dien-1-yl-1-methylpiperidine
CID 12982244
N,N-diethyl-2-methylhept-6-en-1-amine
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CID 89140664

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-methylidene-3-prop-2-enylpiperidine?
The IUPAC name of 1-methyl-4-methylidene-3-prop-2-enylpiperidine (CID 143402603) is 1-methyl-4-methylidene-3-prop-2-enylpiperidine.
What is the SMILES notation for 1-methyl-4-methylidene-3-prop-2-enylpiperidine?
The canonical SMILES for 1-methyl-4-methylidene-3-prop-2-enylpiperidine is C=CCC1CN(C)CCC1=C.
What is the InChIKey of 1-methyl-4-methylidene-3-prop-2-enylpiperidine?
The InChIKey is YVCLPGXFSWVHPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-4-5-10-8-11(3)7-6-9(10)2/h4,10H,1-2,5-8H2,3H3.
What are the key properties of 1-methyl-4-methylidene-3-prop-2-enylpiperidine?
1-methyl-4-methylidene-3-prop-2-enylpiperidine has a molecular weight of 151.25 g/mol, XLogP of 2.07, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-methylidene-3-prop-2-enylpiperidine is sourced from PubChem (CID 143402603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).