2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide

C14H24N4O3 — CID 95780857

IUPAC2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide
SMILESCCCNC(=O)CN1CCC[C@@H]([C@@]2(C)NC(=O)NC2=O)C1
InChIInChI=1S/C14H24N4O3/c1-3-6-15-11(19)9-18-7-4-5-10(8-18)14(2)12(20)16-13(21)17-14/h10H,3-9H2,1-2H3,(H,15,19)(H2,16,17,20,21)/t10-,14-/m1/s1
InChIKeySYHYOSZETTVQMU-QMTHXVAHSA-N
MW296.37 g/mol
LogP-0.18
Rot. Bonds5

About 2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide

2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide (PubChem CID 95780857) has the molecular formula C14H24N4O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide.

Molecular Properties

Compound Name2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide
PubChem CID95780857
Molecular FormulaC14H24N4O3
Molecular Weight296.37 g/mol
Exact Mass296.18
IUPAC Name2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide
SMILESCCCNC(=O)CN1CCC[C@@H]([C@@]2(C)NC(=O)NC2=O)C1
InChIInChI=1S/C14H24N4O3/c1-3-6-15-11(19)9-18-7-4-5-10(8-18)14(2)12(20)16-13(21)17-14/h10H,3-9H2,1-2H3,(H,15,19)(H2,16,17,20,21)/t10-,14-/m1/s1
InChIKeySYHYOSZETTVQMU-QMTHXVAHSA-N
XLogP-0.18
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 5-0.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide?
The IUPAC name of 2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide (CID 95780857) is 2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide.
What is the SMILES notation for 2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide?
The canonical SMILES for 2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide is CCCNC(=O)CN1CCC[C@@H]([C@@]2(C)NC(=O)NC2=O)C1.
What is the InChIKey of 2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide?
The InChIKey is SYHYOSZETTVQMU-QMTHXVAHSA-N. The full InChI is InChI=1S/C14H24N4O3/c1-3-6-15-11(19)9-18-7-4-5-10(8-18)14(2)12(20)16-13(21)17-14/h10H,3-9H2,1-2H3,(H,15,19)(H2,16,17,20,21)/t10-,14-/m1/s1.
What are the key properties of 2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide?
2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide has a molecular weight of 296.37 g/mol, XLogP of -0.18, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide is sourced from PubChem (CID 95780857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).