(Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide

C14H23N5O2 — CID 108863767

IUPAC(Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide
SMILESN#C/C(=C/N1CCOCC1)C(=O)NCCN1CCNCC1
InChIInChI=1S/C14H23N5O2/c15-11-13(12-19-7-9-21-10-8-19)14(20)17-3-6-18-4-1-16-2-5-18/h12,16H,1-10H2,(H,17,20)/b13-12-
InChIKeyOKDKNRWCIBPEJH-SEYXRHQNSA-N
MW293.37 g/mol
LogP-1.25
Rot. Bonds5

About (Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide

(Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide (PubChem CID 108863767) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is (Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide.

Molecular Properties

Compound Name(Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide
PubChem CID108863767
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC Name(Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide
SMILESN#C/C(=C/N1CCOCC1)C(=O)NCCN1CCNCC1
InChIInChI=1S/C14H23N5O2/c15-11-13(12-19-7-9-21-10-8-19)14(20)17-3-6-18-4-1-16-2-5-18/h12,16H,1-10H2,(H,17,20)/b13-12-
InChIKeyOKDKNRWCIBPEJH-SEYXRHQNSA-N
XLogP-1.25
TPSA80.63 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 5-1.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

(Z)-2-cyano-3-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)prop-2-enamide
CID 108862927
2-cyano-3-morpholin-4-yl-N-propylprop-2-enamide
CID 71946765
1-[(Z)-2-cyano-3-(2-morpholin-4-ylethylamino)-3-oxoprop-1-enyl]piperidine-4-carboxamide
CID 108863165
(Z)-2-cyano-3-(4-methylsulfonylpiperazin-1-yl)-N-(2-morpholin-4-ylethyl)prop-2-enamide
CID 108863245
(Z)-2-cyano-3-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-morpholin-4-ylethyl)prop-2-enamide
CID 108863075
(Z)-2-cyano-3-(2,3-dihydroindol-1-yl)-N-(2-piperazin-1-ylethyl)prop-2-enamide
CID 108864173
(Z)-2-cyano-N-(2-piperazin-1-ylethyl)-3-(propan-2-ylamino)prop-2-enamide
CID 108863691
(Z)-2-cyano-3-(2-methoxyethylamino)-N-(2-piperazin-1-ylethyl)prop-2-enamide
CID 108863711
N-(3-morpholin-4-ylpropyl)-N'-(2-piperazin-1-ylethyl)oxamide
CID 108517732
(Z)-3-[bis(prop-2-enyl)amino]-2-cyano-N-(2-piperazin-1-ylethyl)prop-2-enamide
CID 108863861
(Z)-2-(morpholine-4-carbonyl)-3-(2-piperazin-1-ylethylamino)prop-2-enenitrile
CID 108843678
(Z)-2-cyano-3-(4-iodoanilino)-N-(2-piperazin-1-ylethyl)prop-2-enamide
CID 108864175

Frequently Asked Questions

What is the IUPAC name of (Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide?
The IUPAC name of (Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide (CID 108863767) is (Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide.
What is the SMILES notation for (Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide?
The canonical SMILES for (Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide is N#C/C(=C/N1CCOCC1)C(=O)NCCN1CCNCC1.
What is the InChIKey of (Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide?
The InChIKey is OKDKNRWCIBPEJH-SEYXRHQNSA-N. The full InChI is InChI=1S/C14H23N5O2/c15-11-13(12-19-7-9-21-10-8-19)14(20)17-3-6-18-4-1-16-2-5-18/h12,16H,1-10H2,(H,17,20)/b13-12-.
What are the key properties of (Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide?
(Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide has a molecular weight of 293.37 g/mol, XLogP of -1.25, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-cyano-3-morpholin-4-yl-N-(2-piperazin-1-ylethyl)prop-2-enamide is sourced from PubChem (CID 108863767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).