(5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione

About (5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione

(5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione (PubChem CID 42169344) has the molecular formula C26H32FN5O3 and a molecular weight of 481.57 g/mol. Its IUPAC name is (5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name	(5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione
PubChem CID	42169344
Molecular Formula	C26H32FN5O3
Molecular Weight	481.57 g/mol
Exact Mass	481.25
IUPAC Name	(5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione
SMILES	CC(C)CN1C(=O)N[C@](Cc2cccc(F)c2)(C2CCN(C(=O)c3cc(C4CC4)[nH]n3)CC2)C1=O
InChI	InChI=1S/C26H32FN5O3/c1-16(2)15-32-24(34)26(28-25(32)35,14-17-4-3-5-20(27)12-17)19-8-10-31(11-9-19)23(33)22-13-21(29-30-22)18-6-7-18/h3-5,12-13,16,18-19H,6-11,14-15H2,1-2H3,(H,28,35)(H,29,30)/t26-/m1/s1
InChIKey	AHASPMPLPKQRGM-AREMUKBSSA-N
XLogP	3.47
TPSA	98.40 Å²
H-Bond Donors	2
H-Bond Acceptors	4
Rotatable Bonds	7
Heavy Atoms	35
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	481.57
LogP ≤ 5	3.47
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Related Compounds

Frequently Asked Questions

What is the IUPAC name of (5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione?

The IUPAC name of (5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione (CID 42169344) is (5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione.

What is the SMILES notation for (5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione?

The canonical SMILES for (5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione is CC(C)CN1C(=O)N[C@](Cc2cccc(F)c2)(C2CCN(C(=O)c3cc(C4CC4)[nH]n3)CC2)C1=O.

What is the InChIKey of (5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione?

The InChIKey is AHASPMPLPKQRGM-AREMUKBSSA-N. The full InChI is InChI=1S/C26H32FN5O3/c1-16(2)15-32-24(34)26(28-25(32)35,14-17-4-3-5-20(27)12-17)19-8-10-31(11-9-19)23(33)22-13-21(29-30-22)18-6-7-18/h3-5,12-13,16,18-19H,6-11,14-15H2,1-2H3,(H,28,35)(H,29,30)/t26-/m1/s1.

What are the key properties of (5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione?

(5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione has a molecular weight of 481.57 g/mol, XLogP of 3.47, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for (5R)-5-[1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-5-[(3-fluorophenyl)methyl]-3-(2-methylpropyl)imidazolidine-2,4-dione is sourced from PubChem (CID 42169344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).