N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide

C16H26N4O3 — CID 97217656

IUPACN-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide
SMILESCCN1C(=O)N[C@@](C)([C@@H]2CCCN(CC(=O)NC3CC3)C2)C1=O
InChIInChI=1S/C16H26N4O3/c1-3-20-14(22)16(2,18-15(20)23)11-5-4-8-19(9-11)10-13(21)17-12-6-7-12/h11-12H,3-10H2,1-2H3,(H,17,21)(H,18,23)/t11-,16+/m1/s1
InChIKeyJYWZEECPYZPRSG-BZNIZROVSA-N
MW322.41 g/mol
LogP0.31
Rot. Bonds5

About N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide

N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide (PubChem CID 97217656) has the molecular formula C16H26N4O3 and a molecular weight of 322.41 g/mol. Its IUPAC name is N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide
PubChem CID97217656
Molecular FormulaC16H26N4O3
Molecular Weight322.41 g/mol
Exact Mass322.20
IUPAC NameN-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide
SMILESCCN1C(=O)N[C@@](C)([C@@H]2CCCN(CC(=O)NC3CC3)C2)C1=O
InChIInChI=1S/C16H26N4O3/c1-3-20-14(22)16(2,18-15(20)23)11-5-4-8-19(9-11)10-13(21)17-12-6-7-12/h11-12H,3-10H2,1-2H3,(H,17,21)(H,18,23)/t11-,16+/m1/s1
InChIKeyJYWZEECPYZPRSG-BZNIZROVSA-N
XLogP0.31
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 50.31
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

3-ethyl-5-methyl-5-[1-[(4-methylphenyl)methyl]piperidin-3-yl]imidazolidine-2,4-dione
CID 75422495
2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-ethylpyrrolidin-2-yl)methyl]acetamide
CID 128935614
2-[3-(4-methyl-2,5-dioxo-1-propan-2-ylimidazolidin-4-yl)piperidin-1-yl]acetamide
CID 71927194
(5R)-3-ethyl-5-methyl-5-[(3R)-1-(1,2-oxazol-3-ylmethyl)piperidin-3-yl]imidazolidine-2,4-dione
CID 97318217
2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1-cyclopropylpyrrolidin-3-yl)acetamide
CID 47938269
2-[(3R)-3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]-N-propylacetamide
CID 95780857
5-[1-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-3-yl]-3-ethyl-5-methylimidazolidine-2,4-dione
CID 75422498
2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-piperidin-3-ylacetamide;hydrochloride
CID 119424782
N-cyclopentyl-2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 60623061
5-cyclopropyl-5-methyl-3-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride
CID 119488225
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-propylpiperidin-4-yl)acetamide
CID 86907090
N-cyclopropyl-2-[4-[2-[[(4R)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]amino]-2-oxoethyl]piperazin-1-yl]acetamide
CID 30737456

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide (CID 97217656) is N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide is CCN1C(=O)N[C@@](C)([C@@H]2CCCN(CC(=O)NC3CC3)C2)C1=O.
What is the InChIKey of N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide?
The InChIKey is JYWZEECPYZPRSG-BZNIZROVSA-N. The full InChI is InChI=1S/C16H26N4O3/c1-3-20-14(22)16(2,18-15(20)23)11-5-4-8-19(9-11)10-13(21)17-12-6-7-12/h11-12H,3-10H2,1-2H3,(H,17,21)(H,18,23)/t11-,16+/m1/s1.
What are the key properties of N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide?
N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide has a molecular weight of 322.41 g/mol, XLogP of 0.31, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(3R)-3-[(4S)-1-ethyl-4-methyl-2,5-dioxoimidazolidin-4-yl]piperidin-1-yl]acetamide is sourced from PubChem (CID 97217656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).