2-ethylidene-1,3-dimethylpiperidine

C9H17N — CID 151799463

IUPAC2-ethylidene-1,3-dimethylpiperidine
SMILESCC=C1C(C)CCCN1C
InChIInChI=1S/C9H17N/c1-4-9-8(2)6-5-7-10(9)3/h4,8H,5-7H2,1-3H3
InChIKeyRYHNFRJPZUWKJV-UHFFFAOYSA-N
MW139.24 g/mol
LogP2.25
Rot. Bonds

About 2-ethylidene-1,3-dimethylpiperidine

2-ethylidene-1,3-dimethylpiperidine (PubChem CID 151799463) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 2-ethylidene-1,3-dimethylpiperidine.

Molecular Properties

Compound Name2-ethylidene-1,3-dimethylpiperidine
PubChem CID151799463
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name2-ethylidene-1,3-dimethylpiperidine
SMILESCC=C1C(C)CCCN1C
InChIInChI=1S/C9H17N/c1-4-9-8(2)6-5-7-10(9)3/h4,8H,5-7H2,1-3H3
InChIKeyRYHNFRJPZUWKJV-UHFFFAOYSA-N
XLogP2.25
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethylidene-1,3-dimethylpiperidine?
The IUPAC name of 2-ethylidene-1,3-dimethylpiperidine (CID 151799463) is 2-ethylidene-1,3-dimethylpiperidine.
What is the SMILES notation for 2-ethylidene-1,3-dimethylpiperidine?
The canonical SMILES for 2-ethylidene-1,3-dimethylpiperidine is CC=C1C(C)CCCN1C.
What is the InChIKey of 2-ethylidene-1,3-dimethylpiperidine?
The InChIKey is RYHNFRJPZUWKJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-4-9-8(2)6-5-7-10(9)3/h4,8H,5-7H2,1-3H3.
What are the key properties of 2-ethylidene-1,3-dimethylpiperidine?
2-ethylidene-1,3-dimethylpiperidine has a molecular weight of 139.24 g/mol, XLogP of 2.25, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylidene-1,3-dimethylpiperidine is sourced from PubChem (CID 151799463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).