2-but-1-en-2-yl-2-methylpiperidin-1-amine

C10H20N2 — CID 166907252

IUPAC2-but-1-en-2-yl-2-methylpiperidin-1-amine
SMILESC=C(CC)C1(C)CCCCN1N
InChIInChI=1S/C10H20N2/c1-4-9(2)10(3)7-5-6-8-12(10)11/h2,4-8,11H2,1,3H3
InChIKeyIPMDAOQMWYTRNB-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.07
Rot. Bonds2

About 2-but-1-en-2-yl-2-methylpiperidin-1-amine

2-but-1-en-2-yl-2-methylpiperidin-1-amine (PubChem CID 166907252) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 2-but-1-en-2-yl-2-methylpiperidin-1-amine.

Molecular Properties

Compound Name2-but-1-en-2-yl-2-methylpiperidin-1-amine
PubChem CID166907252
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name2-but-1-en-2-yl-2-methylpiperidin-1-amine
SMILESC=C(CC)C1(C)CCCCN1N
InChIInChI=1S/C10H20N2/c1-4-9(2)10(3)7-5-6-8-12(10)11/h2,4-8,11H2,1,3H3
InChIKeyIPMDAOQMWYTRNB-UHFFFAOYSA-N
XLogP2.07
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-Butyl-3-methyl-4-methylidene-1-(2-methylprop-2-enyl)diazinane
CID 123788235
2,2,6,6-Tetramethyl-4-(2-methylidenepentyl)piperidin-1-amine
CID 129059915
2-But-1-en-2-yl-2-ethylpiperidin-1-amine
CID 130243524
4-Pent-1-en-2-ylpiperidin-1-amine
CID 139333183
2-(1-cyclohexylethenyl)-N,2-dimethylpiperidin-1-amine
CID 154985800
2-Ethenyl-3,6-dimethylpiperidin-1-amine
CID 155442201
1-(2-Cyclohexylprop-2-enyl)-1-propylhydrazine
CID 166907399
4-[5-[Butan-2-yl(ethyl)amino]-2-methylidenehexyl]piperidin-1-amine
CID 178648398

Frequently Asked Questions

What is the IUPAC name of 2-but-1-en-2-yl-2-methylpiperidin-1-amine?
The IUPAC name of 2-but-1-en-2-yl-2-methylpiperidin-1-amine (CID 166907252) is 2-but-1-en-2-yl-2-methylpiperidin-1-amine.
What is the SMILES notation for 2-but-1-en-2-yl-2-methylpiperidin-1-amine?
The canonical SMILES for 2-but-1-en-2-yl-2-methylpiperidin-1-amine is C=C(CC)C1(C)CCCCN1N.
What is the InChIKey of 2-but-1-en-2-yl-2-methylpiperidin-1-amine?
The InChIKey is IPMDAOQMWYTRNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-4-9(2)10(3)7-5-6-8-12(10)11/h2,4-8,11H2,1,3H3.
What are the key properties of 2-but-1-en-2-yl-2-methylpiperidin-1-amine?
2-but-1-en-2-yl-2-methylpiperidin-1-amine has a molecular weight of 168.28 g/mol, XLogP of 2.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-but-1-en-2-yl-2-methylpiperidin-1-amine is sourced from PubChem (CID 166907252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).