2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide

C15H27N3O — CID 3229544

IUPAC2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C15H27N3O/c1-2-8-16-15(19)13-17-11-6-14(7-12-17)18-9-4-3-5-10-18/h2,14H,1,3-13H2,(H,16,19)
InChIKeyZJYQTDBWMSTMGI-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.24
Rot. Bonds5

About 2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide

2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide (PubChem CID 3229544) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide
PubChem CID3229544
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C15H27N3O/c1-2-8-16-15(19)13-17-11-6-14(7-12-17)18-9-4-3-5-10-18/h2,14H,1,3-13H2,(H,16,19)
InChIKeyZJYQTDBWMSTMGI-UHFFFAOYSA-N
XLogP1.24
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.24
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

2-[4-(Methylamino)piperidin-1-yl]-1-(4-methylpiperazin-1-yl)ethan-1-one
CID 50989053
2-(4-methylpiperazin-1-yl)-N-prop-2-enylpropanamide
CID 3229462
4-Acetyl-1-piperidin-4-ylpiperazin-2-one
CID 134790151
1-[4-(Piperazin-1-yl)piperidin-1-yl]prop-2-en-1-one
CID 142769174
2-[cyclohexyl(methyl)amino]-N-prop-2-enylacetamide
CID 51072753
N-cyclopropyl-2-[4-(2,5-dihydropyrrol-1-yl)piperidin-1-yl]propanamide
CID 72111255
1-[4-(Prop-2-enylamino)piperidin-1-yl]ethanone
CID 43222826
2,2-dimethyl-N-[1-[2-oxo-2-(prop-2-enylamino)ethyl]piperidin-4-yl]propanamide
CID 3220787
1-Piperidin-4-yl-4-prop-2-enylpiperazine-2,3-dione
CID 20956025
N-(1'-methyl-1,4'-bipiperidin-3-yl)-3-butenamide
CID 45247182
2-(4-piperidin-1-ylpiperidin-1-yl)-N-propan-2-ylacetamide
CID 1439630
1-Piperidin-1-yl-2-(piperidin-4-ylamino)ethanone
CID 10242781

Frequently Asked Questions

What is the IUPAC name of 2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide?
The IUPAC name of 2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide (CID 3229544) is 2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide.
What is the SMILES notation for 2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide?
The canonical SMILES for 2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide is C=CCNC(=O)CN1CCC(N2CCCCC2)CC1.
What is the InChIKey of 2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide?
The InChIKey is ZJYQTDBWMSTMGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-2-8-16-15(19)13-17-11-6-14(7-12-17)18-9-4-3-5-10-18/h2,14H,1,3-13H2,(H,16,19).
What are the key properties of 2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide?
2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide has a molecular weight of 265.40 g/mol, XLogP of 1.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylacetamide is sourced from PubChem (CID 3229544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).