3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione

C11H17N5O2 — CID 95611974

IUPAC3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione
SMILESC[C@H](Cn1cccn1)NCCN1C(=O)CNC1=O
InChIInChI=1S/C11H17N5O2/c1-9(8-15-5-2-3-14-15)12-4-6-16-10(17)7-13-11(16)18/h2-3,5,9,12H,4,6-8H2,1H3,(H,13,18)/t9-/m1/s1
InChIKeyHGWKOGWSZVZXTN-SECBINFHSA-N
MW251.29 g/mol
LogP-0.59
Rot. Bonds6

About 3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione

3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione (PubChem CID 95611974) has the molecular formula C11H17N5O2 and a molecular weight of 251.29 g/mol. Its IUPAC name is 3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione
PubChem CID95611974
Molecular FormulaC11H17N5O2
Molecular Weight251.29 g/mol
Exact Mass251.14
IUPAC Name3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione
SMILESC[C@H](Cn1cccn1)NCCN1C(=O)CNC1=O
InChIInChI=1S/C11H17N5O2/c1-9(8-15-5-2-3-14-15)12-4-6-16-10(17)7-13-11(16)18/h2-3,5,9,12H,4,6-8H2,1H3,(H,13,18)/t9-/m1/s1
InChIKeyHGWKOGWSZVZXTN-SECBINFHSA-N
XLogP-0.59
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione with MolForge

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Related Compounds

3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione
CID 99639251
1-imidazol-1-yl-N-(2-pyrazol-1-ylethyl)propan-2-amine
CID 61491585
N-(2-fluoroethyl)-1-pyrazol-1-ylpropan-2-amine
CID 80601447
N-ethyl-1-pyrazol-1-ylpropan-2-amine
CID 43435880
N',N'-diethyl-N-(1-pyrazol-1-ylpropan-2-yl)ethane-1,2-diamine
CID 61462605
(2R)-N-(3-methylsulfonylpropyl)-1-pyrazol-1-ylpropan-2-amine
CID 95027950
(2S)-N-[2-(2-methylindol-1-yl)ethyl]-1-pyrazol-1-ylpropan-2-amine
CID 95221915
1-chloro-N-(2-pyrazol-1-ylethyl)propan-2-amine
CID 65025560
2-methyl-3-(1-pyrazol-1-ylpropan-2-ylamino)propanoic acid
CID 61462644
N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-pyrazol-1-ylpropan-2-amine
CID 131935574
(2R)-N-[3-(benzenesulfonyl)propyl]-1-pyrazol-1-ylpropan-2-amine
CID 95279364
(2R)-N-[2-[(1R,2R)-2-methylcyclohexyl]oxyethyl]-1-pyrazol-1-ylpropan-2-amine
CID 124810591

Frequently Asked Questions

What is the IUPAC name of 3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione?
The IUPAC name of 3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione (CID 95611974) is 3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione?
The canonical SMILES for 3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione is C[C@H](Cn1cccn1)NCCN1C(=O)CNC1=O.
What is the InChIKey of 3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione?
The InChIKey is HGWKOGWSZVZXTN-SECBINFHSA-N. The full InChI is InChI=1S/C11H17N5O2/c1-9(8-15-5-2-3-14-15)12-4-6-16-10(17)7-13-11(16)18/h2-3,5,9,12H,4,6-8H2,1H3,(H,13,18)/t9-/m1/s1.
What are the key properties of 3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione?
3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione has a molecular weight of 251.29 g/mol, XLogP of -0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 95611974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).