(2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide

C19H33N3O — CID 1439550

IUPAC(2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide
SMILESC=CCN(CC=C)C(=O)[C@@H](C)N1CCN(C2CCCCC2)CC1
InChIInChI=1S/C19H33N3O/c1-4-11-22(12-5-2)19(23)17(3)20-13-15-21(16-14-20)18-9-7-6-8-10-18/h4-5,17-18H,1-2,6-16H2,3H3/t17-/m1/s1
InChIKeyNZEDRVNYWBESOQ-QGZVFWFLSA-N
MW319.49 g/mol
LogP2.53
Rot. Bonds7

About (2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide

(2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide (PubChem CID 1439550) has the molecular formula C19H33N3O and a molecular weight of 319.49 g/mol. Its IUPAC name is (2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide
PubChem CID1439550
Molecular FormulaC19H33N3O
Molecular Weight319.49 g/mol
Exact Mass319.26
IUPAC Name(2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide
SMILESC=CCN(CC=C)C(=O)[C@@H](C)N1CCN(C2CCCCC2)CC1
InChIInChI=1S/C19H33N3O/c1-4-11-22(12-5-2)19(23)17(3)20-13-15-21(16-14-20)18-9-7-6-8-10-18/h4-5,17-18H,1-2,6-16H2,3H3/t17-/m1/s1
InChIKeyNZEDRVNYWBESOQ-QGZVFWFLSA-N
XLogP2.53
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.49
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(4-hydroxypiperidin-1-yl)-N,N-bis(prop-2-enyl)propanamide
CID 110884233
(2S)-2-(4-cyclopentylpiperazin-1-yl)-N-prop-2-enylpropanamide
CID 94062189
ethyl 2-(4-cyclopentylpiperazin-1-yl)propanoate
CID 55063212
2-[(8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-N,N-bis(prop-2-enyl)acetamide
CID 124749240
1-butan-2-yl-4-cyclohexylpiperazine;oxalic acid
CID 17369821
1,4-dicyclohexyl-7-[1-(4,7-dicyclohexyl-1,4,7-triazonan-1-yl)ethyl]-1,4,7-triazonane
CID 23439594
oxalic acid;2-(4-piperidin-1-ylpiperidin-1-yl)-N-prop-2-enylpropanamide
CID 171668900
1-(4-cycloheptylpiperazin-1-yl)-2-methylpropan-1-one
CID 59205252
(2R)-1-(4-cyclopentyl-1,4-diazepan-1-yl)-2-prop-2-enylsulfanylpropan-1-one
CID 95397603
1-(4-cycloheptylpiperazin-1-yl)-3-methylbutan-1-one
CID 113074898
2-(4-cyclopentylpiperazin-1-yl)butanoic acid
CID 62368953
2-(3,4-dioxo-2,6,7,9-tetrahydropyrazino[2,1-c][1,2,4]triazin-8-yl)-N,N-bis(prop-2-enyl)propanamide
CID 166303756

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide?
The IUPAC name of (2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide (CID 1439550) is (2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide.
What is the SMILES notation for (2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide?
The canonical SMILES for (2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide is C=CCN(CC=C)C(=O)[C@@H](C)N1CCN(C2CCCCC2)CC1.
What is the InChIKey of (2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide?
The InChIKey is NZEDRVNYWBESOQ-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H33N3O/c1-4-11-22(12-5-2)19(23)17(3)20-13-15-21(16-14-20)18-9-7-6-8-10-18/h4-5,17-18H,1-2,6-16H2,3H3/t17-/m1/s1.
What are the key properties of (2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide?
(2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide has a molecular weight of 319.49 g/mol, XLogP of 2.53, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-cyclohexylpiperazin-1-yl)-N,N-bis(prop-2-enyl)propanamide is sourced from PubChem (CID 1439550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).