3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione

C14H24N2O2 — CID 64886762

IUPAC3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione
SMILESCC(C)CC1C(=O)NC(C2CC2)C(=O)N1C(C)C
InChIInChI=1S/C14H24N2O2/c1-8(2)7-11-13(17)15-12(10-5-6-10)14(18)16(11)9(3)4/h8-12H,5-7H2,1-4H3,(H,15,17)
InChIKeyZCSQXJFBQCWNKH-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.55
Rot. Bonds4

About 3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione

3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione (PubChem CID 64886762) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione
PubChem CID64886762
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione
SMILESCC(C)CC1C(=O)NC(C2CC2)C(=O)N1C(C)C
InChIInChI=1S/C14H24N2O2/c1-8(2)7-11-13(17)15-12(10-5-6-10)14(18)16(11)9(3)4/h8-12H,5-7H2,1-4H3,(H,15,17)
InChIKeyZCSQXJFBQCWNKH-UHFFFAOYSA-N
XLogP1.55
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopropyl-1-(4-methoxybutan-2-yl)-6-(2-methylpropyl)piperazine-2,5-dione
CID 116500131
3-cyclopropyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione
CID 64885420
1-butan-2-yl-3-cyclopropyl-6-ethylpiperazine-2,5-dione
CID 64957501
3-cyclopropyl-6-(2-methylpropyl)-1-(2-methylsulfonylethyl)piperazine-2,5-dione
CID 64885823
6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione
CID 64886770
3-cyclopropyl-6-ethyl-1-pentan-2-ylpiperazine-2,5-dione
CID 64957333
3-cyclopropyl-1-(5-methylhexan-2-yl)-6-propan-2-ylpiperazine-2,5-dione
CID 64971527
(3S,6S,9S,12S,15R,18R,21R)-6,15-dicyclopropyl-1,3,4,10,12,13,21-heptamethyl-9,18-bis(2-methylpropyl)-1,4,7,10,13,16,19-heptazacyclohenicosane-2,5,8,11,14,17,20-heptone
CID 126755549
3-cyclopropyl-6-ethyl-1-hexan-2-ylpiperazine-2,5-dione
CID 64968978
3-cyclohexyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione
CID 64887376
3-cyclopropyl-6-(2-methylpropyl)-1-(thiophen-2-ylmethyl)piperazine-2,5-dione
CID 64885635
3-cyclopropyl-6-ethyl-1-[1-(5-methylfuran-2-yl)ethyl]piperazine-2,5-dione
CID 64965675

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione (CID 64886762) is 3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione is CC(C)CC1C(=O)NC(C2CC2)C(=O)N1C(C)C.
What is the InChIKey of 3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione?
The InChIKey is ZCSQXJFBQCWNKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-8(2)7-11-13(17)15-12(10-5-6-10)14(18)16(11)9(3)4/h8-12H,5-7H2,1-4H3,(H,15,17).
What are the key properties of 3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione?
3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione has a molecular weight of 252.36 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-6-(2-methylpropyl)-1-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 64886762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).