(5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione

C9H15N3O2 — CID 99978564

IUPAC(5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione
SMILESC[C@]1(C[C@H]2CCCN2)NC(=O)NC1=O
InChIInChI=1S/C9H15N3O2/c1-9(5-6-3-2-4-10-6)7(13)11-8(14)12-9/h6,10H,2-5H2,1H3,(H2,11,12,13,14)/t6-,9-/m1/s1
InChIKeyKLQZPAVZGUJVAF-HZGVNTEJSA-N
MW197.24 g/mol
LogP-0.27
Rot. Bonds2

About (5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione

(5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione (PubChem CID 99978564) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is (5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione
PubChem CID99978564
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name(5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione
SMILESC[C@]1(C[C@H]2CCCN2)NC(=O)NC1=O
InChIInChI=1S/C9H15N3O2/c1-9(5-6-3-2-4-10-6)7(13)11-8(14)12-9/h6,10H,2-5H2,1H3,(H2,11,12,13,14)/t6-,9-/m1/s1
InChIKeyKLQZPAVZGUJVAF-HZGVNTEJSA-N
XLogP-0.27
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-0.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione with MolForge

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Related Compounds

(5S)-5-methyl-5-[[(2S)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione
CID 99978559
(5R)-5-methyl-5-(methylsulfonylmethyl)imidazolidine-2,4-dione
CID 59710540
(2S)-2-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyrrolidine
CID 69341147
5-methyl-5-(piperidin-2-ylmethyl)-1,3-oxazolidin-2-one
CID 117158959
4,4-dimethyl-1-(pyrrolidin-2-ylmethyl)piperidine-2,6-dione
CID 62930379
4-methoxy-3-(4-methyl-2,5-dioxoimidazolidin-4-yl)-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide
CID 119974457
1,1-dimethylcyclopropane;ethane;[(2S)-pyrrolidin-2-yl]methanol
CID 142267909
1-[[(4S)-4-methyl-2,5-dioxoimidazolidin-4-yl]methylsulfonyl]piperidine-4-carboxylic acid
CID 69288109
2,2-dimethyl-6-(pyrrolidin-2-ylmethyl)-4H-1,4-benzoxazin-3-one
CID 82339550
2,4-dimethyl-2-(pyrrolidin-2-ylmethyl)-1,3-oxazolidine
CID 117228010
2,4,4-trimethyl-2-(pyrrolidin-2-ylmethyl)-1,3-oxazolidine;hydrochloride
CID 117228013
3,4-dimethyl-1-[[(2R)-pyrrolidin-2-yl]methyl]pyrrolidine-2,5-dione
CID 102819845

Frequently Asked Questions

What is the IUPAC name of (5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione (CID 99978564) is (5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione is C[C@]1(C[C@H]2CCCN2)NC(=O)NC1=O.
What is the InChIKey of (5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione?
The InChIKey is KLQZPAVZGUJVAF-HZGVNTEJSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-9(5-6-3-2-4-10-6)7(13)11-8(14)12-9/h6,10H,2-5H2,1H3,(H2,11,12,13,14)/t6-,9-/m1/s1.
What are the key properties of (5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione?
(5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione has a molecular weight of 197.24 g/mol, XLogP of -0.27, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 99978564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).