1-methyl-2-propa-1,2-dienylpiperidine

C9H15N — CID 134716119

IUPAC1-methyl-2-propa-1,2-dienylpiperidine
SMILESC=C=CC1CCCCN1C
InChIInChI=1S/C9H15N/c1-3-6-9-7-4-5-8-10(9)2/h6,9H,1,4-5,7-8H2,2H3
InChIKeyBZWSKJFHESQOQQ-UHFFFAOYSA-N
MW137.23 g/mol
LogP1.81
Rot. Bonds1

About 1-methyl-2-propa-1,2-dienylpiperidine

1-methyl-2-propa-1,2-dienylpiperidine (PubChem CID 134716119) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 1-methyl-2-propa-1,2-dienylpiperidine.

Molecular Properties

Compound Name1-methyl-2-propa-1,2-dienylpiperidine
PubChem CID134716119
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name1-methyl-2-propa-1,2-dienylpiperidine
SMILESC=C=CC1CCCCN1C
InChIInChI=1S/C9H15N/c1-3-6-9-7-4-5-8-10(9)2/h6,9H,1,4-5,7-8H2,2H3
InChIKeyBZWSKJFHESQOQQ-UHFFFAOYSA-N
XLogP1.81
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-propa-1,2-dienylpiperidine?
The IUPAC name of 1-methyl-2-propa-1,2-dienylpiperidine (CID 134716119) is 1-methyl-2-propa-1,2-dienylpiperidine.
What is the SMILES notation for 1-methyl-2-propa-1,2-dienylpiperidine?
The canonical SMILES for 1-methyl-2-propa-1,2-dienylpiperidine is C=C=CC1CCCCN1C.
What is the InChIKey of 1-methyl-2-propa-1,2-dienylpiperidine?
The InChIKey is BZWSKJFHESQOQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-3-6-9-7-4-5-8-10(9)2/h6,9H,1,4-5,7-8H2,2H3.
What are the key properties of 1-methyl-2-propa-1,2-dienylpiperidine?
1-methyl-2-propa-1,2-dienylpiperidine has a molecular weight of 137.23 g/mol, XLogP of 1.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-propa-1,2-dienylpiperidine is sourced from PubChem (CID 134716119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).