N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide

C10H17N3O2 — CID 43700635

IUPACN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide
SMILESC=CC(=O)NC1CCN(CC(N)=O)CC1
InChIInChI=1S/C10H17N3O2/c1-2-10(15)12-8-3-5-13(6-4-8)7-9(11)14/h2,8H,1,3-7H2,(H2,11,14)(H,12,15)
InChIKeyPJLWYPYWVNMRGL-UHFFFAOYSA-N
MW211.26 g/mol
LogP-0.76
Rot. Bonds4

About N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide

N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide (PubChem CID 43700635) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide.

Molecular Properties

Compound NameN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide
PubChem CID43700635
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC NameN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide
SMILESC=CC(=O)NC1CCN(CC(N)=O)CC1
InChIInChI=1S/C10H17N3O2/c1-2-10(15)12-8-3-5-13(6-4-8)7-9(11)14/h2,8H,1,3-7H2,(H2,11,14)(H,12,15)
InChIKeyPJLWYPYWVNMRGL-UHFFFAOYSA-N
XLogP-0.76
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-propylpiperidin-4-yl)prop-2-enamide
CID 61251540
2-[4-[(2-chloroacetyl)amino]piperidin-1-yl]acetamide
CID 43425925
N-(1-ethylpyrrolidin-3-yl)prop-2-enamide
CID 130959352
3-(prop-2-enoylamino)pyrrolidine-1-carboxamide
CID 130617016
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide
CID 60868376
2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate
CID 79346332
2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide
CID 43746855
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-(4-tert-butylphenyl)prop-2-enamide
CID 103597803
2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]acetamide
CID 43746779
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(tert-butylamino)acetamide
CID 49487861
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-chloro-2,2-dimethylpropanamide
CID 63680196
N-(4-aminocyclohexyl)prop-2-enamide
CID 62319252

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide?
The IUPAC name of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide (CID 43700635) is N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide.
What is the SMILES notation for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide?
The canonical SMILES for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide is C=CC(=O)NC1CCN(CC(N)=O)CC1.
What is the InChIKey of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide?
The InChIKey is PJLWYPYWVNMRGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-2-10(15)12-8-3-5-13(6-4-8)7-9(11)14/h2,8H,1,3-7H2,(H2,11,14)(H,12,15).
What are the key properties of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide?
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide has a molecular weight of 211.26 g/mol, XLogP of -0.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide is sourced from PubChem (CID 43700635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).