(Z)-3-amino-3-piperidin-4-ylprop-2-enamide

C8H15N3O — CID 148688479

IUPAC(Z)-3-amino-3-piperidin-4-ylprop-2-enamide
SMILESNC(=O)/C=C(\N)C1CCNCC1
InChIInChI=1S/C8H15N3O/c9-7(5-8(10)12)6-1-3-11-4-2-6/h5-6,11H,1-4,9H2,(H2,10,12)/b7-5-
InChIKeyNSZCEEWEOVAHJR-ALCCZGGFSA-N
MW169.23 g/mol
LogP-0.69
Rot. Bonds2

About (Z)-3-amino-3-piperidin-4-ylprop-2-enamide

(Z)-3-amino-3-piperidin-4-ylprop-2-enamide (PubChem CID 148688479) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is (Z)-3-amino-3-piperidin-4-ylprop-2-enamide.

Molecular Properties

Compound Name(Z)-3-amino-3-piperidin-4-ylprop-2-enamide
PubChem CID148688479
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name(Z)-3-amino-3-piperidin-4-ylprop-2-enamide
SMILESNC(=O)/C=C(\N)C1CCNCC1
InChIInChI=1S/C8H15N3O/c9-7(5-8(10)12)6-1-3-11-4-2-6/h5-6,11H,1-4,9H2,(H2,10,12)/b7-5-
InChIKeyNSZCEEWEOVAHJR-ALCCZGGFSA-N
XLogP-0.69
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 5-0.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-amino-3-piperidin-4-ylprop-2-enamide?
The IUPAC name of (Z)-3-amino-3-piperidin-4-ylprop-2-enamide (CID 148688479) is (Z)-3-amino-3-piperidin-4-ylprop-2-enamide.
What is the SMILES notation for (Z)-3-amino-3-piperidin-4-ylprop-2-enamide?
The canonical SMILES for (Z)-3-amino-3-piperidin-4-ylprop-2-enamide is NC(=O)/C=C(\N)C1CCNCC1.
What is the InChIKey of (Z)-3-amino-3-piperidin-4-ylprop-2-enamide?
The InChIKey is NSZCEEWEOVAHJR-ALCCZGGFSA-N. The full InChI is InChI=1S/C8H15N3O/c9-7(5-8(10)12)6-1-3-11-4-2-6/h5-6,11H,1-4,9H2,(H2,10,12)/b7-5-.
What are the key properties of (Z)-3-amino-3-piperidin-4-ylprop-2-enamide?
(Z)-3-amino-3-piperidin-4-ylprop-2-enamide has a molecular weight of 169.23 g/mol, XLogP of -0.69, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-3-piperidin-4-ylprop-2-enamide is sourced from PubChem (CID 148688479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).