N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide

C15H25N3O2 — CID 8547843

IUPACN-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide
SMILESCCCN(C(=O)CN1CCNC(=O)C1)C1=CCCCC1
InChIInChI=1S/C15H25N3O2/c1-2-9-18(13-6-4-3-5-7-13)15(20)12-17-10-8-16-14(19)11-17/h6H,2-5,7-12H2,1H3,(H,16,19)
InChIKeyZYIZKAGNKOTPKJ-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.11
Rot. Bonds5

About N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide

N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide (PubChem CID 8547843) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide.

Molecular Properties

Compound NameN-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide
PubChem CID8547843
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide
SMILESCCCN(C(=O)CN1CCNC(=O)C1)C1=CCCCC1
InChIInChI=1S/C15H25N3O2/c1-2-9-18(13-6-4-3-5-7-13)15(20)12-17-10-8-16-14(19)11-17/h6H,2-5,7-12H2,1H3,(H,16,19)
InChIKeyZYIZKAGNKOTPKJ-UHFFFAOYSA-N
XLogP1.11
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3,6-dioxo-4-(2-piperidin-1-ylethylamino)cyclohexa-1,4-dien-1-yl]acetamide
CID 137634599
2-[[2-[Cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]acetamide
CID 53509847
2-[[2-[Cyclopenten-1-yl(ethyl)amino]-2-oxoethyl]-propan-2-ylamino]acetamide
CID 56809318
2-[[2-[Cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-propan-2-ylamino]acetamide
CID 56809319
2H-Azepin-2-one, 1,5,6,7-tetrahydro-3-(1-piperidinyl)-
CID 11321492
2(1H)-Pyridinone, 5,6-dihydro-3-(1-piperidinyl)-
CID 12228553
Hexahydro-2(1h)-quinoxalinone
CID 66803355
N-[2-(cyclohexen-1-yl)ethyl]-2-(3-oxopiperazin-1-yl)acetamide
CID 8963352
N-[2-(cyclohexen-1-yl)ethyl]-2-[(2S)-2-methylpiperidin-1-yl]acetamide
CID 51970034
N-cyclohex-3-en-1-yl-1-propan-2-ylpiperidine-2-carboxamide
CID 72001115
4-Acetyltetrahydroquinoxalin-2-one
CID 129788254
N-tert-butyl-2-[4-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]piperazin-1-yl]acetamide
CID 17431600

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide?
The IUPAC name of N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide (CID 8547843) is N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide.
What is the SMILES notation for N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide?
The canonical SMILES for N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide is CCCN(C(=O)CN1CCNC(=O)C1)C1=CCCCC1.
What is the InChIKey of N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide?
The InChIKey is ZYIZKAGNKOTPKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-2-9-18(13-6-4-3-5-7-13)15(20)12-17-10-8-16-14(19)11-17/h6H,2-5,7-12H2,1H3,(H,16,19).
What are the key properties of N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide?
N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide has a molecular weight of 279.38 g/mol, XLogP of 1.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide is sourced from PubChem (CID 8547843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).