5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide

C13H25N3O — CID 137427821

IUPAC5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide
SMILESC=C(N)CCCC(=O)NCCC1CCCCN1
InChIInChI=1S/C13H25N3O/c1-11(14)5-4-7-13(17)16-10-8-12-6-2-3-9-15-12/h12,15H,1-10,14H2,(H,16,17)
InChIKeyRVVXHRUBYGZIOD-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.28
Rot. Bonds7

About 5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide

5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide (PubChem CID 137427821) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide.

Molecular Properties

Compound Name5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide
PubChem CID137427821
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide
SMILESC=C(N)CCCC(=O)NCCC1CCCCN1
InChIInChI=1S/C13H25N3O/c1-11(14)5-4-7-13(17)16-10-8-12-6-2-3-9-15-12/h12,15H,1-10,14H2,(H,16,17)
InChIKeyRVVXHRUBYGZIOD-UHFFFAOYSA-N
XLogP1.28
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide?
The IUPAC name of 5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide (CID 137427821) is 5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide.
What is the SMILES notation for 5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide?
The canonical SMILES for 5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide is C=C(N)CCCC(=O)NCCC1CCCCN1.
What is the InChIKey of 5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide?
The InChIKey is RVVXHRUBYGZIOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-11(14)5-4-7-13(17)16-10-8-12-6-2-3-9-15-12/h12,15H,1-10,14H2,(H,16,17).
What are the key properties of 5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide?
5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide has a molecular weight of 239.36 g/mol, XLogP of 1.28, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-piperidin-2-ylethyl)hex-5-enamide is sourced from PubChem (CID 137427821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).