2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride

C15H27ClN4O3 — CID 119826446

IUPAC2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
SMILESCCCN(C(=O)CN1C(=O)NC(=O)C1(C)C)C1CCNCC1.Cl
InChIInChI=1S/C15H26N4O3.ClH/c1-4-9-18(11-5-7-16-8-6-11)12(20)10-19-14(22)17-13(21)15(19,2)3;/h11,16H,4-10H2,1-3H3,(H,17,21,22);1H
InChIKeyBYCWJZAZRKJWDD-UHFFFAOYSA-N
MW346.86 g/mol
LogP0.73
Rot. Bonds5

About 2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride

2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride (PubChem CID 119826446) has the molecular formula C15H27ClN4O3 and a molecular weight of 346.86 g/mol. Its IUPAC name is 2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride.

Molecular Properties

Compound Name2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
PubChem CID119826446
Molecular FormulaC15H27ClN4O3
Molecular Weight346.86 g/mol
Exact Mass346.18
IUPAC Name2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
SMILESCCCN(C(=O)CN1C(=O)NC(=O)C1(C)C)C1CCNCC1.Cl
InChIInChI=1S/C15H26N4O3.ClH/c1-4-9-18(11-5-7-16-8-6-11)12(20)10-19-14(22)17-13(21)15(19,2)3;/h11,16H,4-10H2,1-3H3,(H,17,21,22);1H
InChIKeyBYCWJZAZRKJWDD-UHFFFAOYSA-N
XLogP0.73
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.86
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-piperidin-4-yl-N-propyl-2-propylsulfanylacetamide;hydrochloride
CID 119824316
2-(2,4-dioxoimidazolidin-1-yl)-N-propyl-N-pyrrolidin-3-ylacetamide
CID 119530519
2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-propyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119530186
2-(8-ethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-piperidin-4-yl-N-propylacetamide
CID 119824077
2-(2-oxopyrrolidin-1-yl)-N-propyl-N-pyrrolidin-3-ylacetamide
CID 60806352
3,3,3-trifluoro-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119824721
3-ethyl-N-piperidin-4-yl-N-propylpentanamide;hydrochloride
CID 119824289
N-piperidin-4-yl-N-propyl-2-(trifluoromethylsulfanyl)acetamide;hydrochloride
CID 119823659
2-(4,5-dimethyl-2-oxo-1,3-thiazol-3-yl)-N-propyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119532672
N-piperidin-4-yl-N-propylhexanamide
CID 60807623
2-(2-oxoazepan-1-yl)-N-propyl-N-pyrrolidin-3-ylacetamide
CID 119531180
3,3-dimethyl-5-oxo-5-[piperidin-4-yl(propyl)amino]pentanoic acid
CID 62935444

Frequently Asked Questions

What is the IUPAC name of 2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
The IUPAC name of 2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride (CID 119826446) is 2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride.
What is the SMILES notation for 2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
The canonical SMILES for 2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride is CCCN(C(=O)CN1C(=O)NC(=O)C1(C)C)C1CCNCC1.Cl.
What is the InChIKey of 2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
The InChIKey is BYCWJZAZRKJWDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O3.ClH/c1-4-9-18(11-5-7-16-8-6-11)12(20)10-19-14(22)17-13(21)15(19,2)3;/h11,16H,4-10H2,1-3H3,(H,17,21,22);1H.
What are the key properties of 2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride has a molecular weight of 346.86 g/mol, XLogP of 0.73, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride is sourced from PubChem (CID 119826446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).