N-(1-ethylpiperidin-4-yl)prop-2-enamide

C10H18N2O — CID 61040354

IUPACN-(1-ethylpiperidin-4-yl)prop-2-enamide
SMILESC=CC(=O)NC1CCN(CC)CC1
InChIInChI=1S/C10H18N2O/c1-3-10(13)11-9-5-7-12(4-2)8-6-9/h3,9H,1,4-8H2,2H3,(H,11,13)
InChIKeyYAVUHNFYYUYKTQ-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.77
Rot. Bonds3

About N-(1-ethylpiperidin-4-yl)prop-2-enamide

N-(1-ethylpiperidin-4-yl)prop-2-enamide (PubChem CID 61040354) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)prop-2-enamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)prop-2-enamide
PubChem CID61040354
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC NameN-(1-ethylpiperidin-4-yl)prop-2-enamide
SMILESC=CC(=O)NC1CCN(CC)CC1
InChIInChI=1S/C10H18N2O/c1-3-10(13)11-9-5-7-12(4-2)8-6-9/h3,9H,1,4-8H2,2H3,(H,11,13)
InChIKeyYAVUHNFYYUYKTQ-UHFFFAOYSA-N
XLogP0.77
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 N-(1-ethylpiperidin-4-yl)prop-2-enamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)prop-2-enamide (CID 61040354) is N-(1-ethylpiperidin-4-yl)prop-2-enamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)prop-2-enamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)prop-2-enamide is C=CC(=O)NC1CCN(CC)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)prop-2-enamide?
The InChIKey is YAVUHNFYYUYKTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-3-10(13)11-9-5-7-12(4-2)8-6-9/h3,9H,1,4-8H2,2H3,(H,11,13).
What are the key properties of N-(1-ethylpiperidin-4-yl)prop-2-enamide?
N-(1-ethylpiperidin-4-yl)prop-2-enamide has a molecular weight of 182.27 g/mol, XLogP of 0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)prop-2-enamide is sourced from PubChem (CID 61040354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).