N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide

C19H23N3O2 — CID 47488355

IUPACN-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide
SMILESC=CCn1cc(C(=O)NCC(=O)N2CCCCC2)c2ccccc21
InChIInChI=1S/C19H23N3O2/c1-2-10-22-14-16(15-8-4-5-9-17(15)22)19(24)20-13-18(23)21-11-6-3-7-12-21/h2,4-5,8-9,14H,1,3,6-7,10-13H2,(H,20,24)
InChIKeyUPWRXJYLOJHRFB-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.57
Rot. Bonds5

About N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide

N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide (PubChem CID 47488355) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide.

Molecular Properties

Compound NameN-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide
PubChem CID47488355
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide
SMILESC=CCn1cc(C(=O)NCC(=O)N2CCCCC2)c2ccccc21
InChIInChI=1S/C19H23N3O2/c1-2-10-22-14-16(15-8-4-5-9-17(15)22)19(24)20-13-18(23)21-11-6-3-7-12-21/h2,4-5,8-9,14H,1,3,6-7,10-13H2,(H,20,24)
InChIKeyUPWRXJYLOJHRFB-UHFFFAOYSA-N
XLogP2.57
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(azepan-1-yl)-2-oxoethyl]indole-3-carboxylic acid
CID 43825868
1-prop-2-enyl-N-(1H-pyrazol-5-ylmethyl)indole-3-carboxamide
CID 56819715
2-[[2-(azocan-1-yl)-2-oxoethyl]amino]-N-prop-2-enylbenzamide
CID 86911517
2-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzamide
CID 36866031
2,2-dimethyl-1-[1-(2-oxo-2-piperidin-1-ylethyl)indol-3-yl]propan-1-one
CID 1095445
2-[3-(cyclohexanecarbonyl)indol-1-yl]-1-pyrrolidin-1-ylethanone
CID 654893
ethyl 2-[[2-oxo-2-[1-(2-oxo-2-piperidin-1-ylethyl)indol-3-yl]acetyl]amino]acetate
CID 7162391
3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl-(1-prop-2-enylindol-3-yl)methanone
CID 71886045
N-[2-(azepan-1-yl)-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 7964073
2-chloro-N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide
CID 30543359
N-(3,3-diphenylpropyl)-2-oxo-2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]acetamide
CID 16808104
(4-iodophenyl)-(1-prop-2-enylindol-3-yl)methanone
CID 170857263

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide?
The IUPAC name of N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide (CID 47488355) is N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide.
What is the SMILES notation for N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide?
The canonical SMILES for N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide is C=CCn1cc(C(=O)NCC(=O)N2CCCCC2)c2ccccc21.
What is the InChIKey of N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide?
The InChIKey is UPWRXJYLOJHRFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-2-10-22-14-16(15-8-4-5-9-17(15)22)19(24)20-13-18(23)21-11-6-3-7-12-21/h2,4-5,8-9,14H,1,3,6-7,10-13H2,(H,20,24).
What are the key properties of N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide?
N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-2-piperidin-1-ylethyl)-1-prop-2-enylindole-3-carboxamide is sourced from PubChem (CID 47488355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).