3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione

C18H26N4O3 — CID 56713349

IUPAC3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione
SMILESCCCC1(C2CCNCC2)NC(=O)N(Cc2cc(OC)ccn2)C1=O
InChIInChI=1S/C18H26N4O3/c1-3-7-18(13-4-8-19-9-5-13)16(23)22(17(24)21-18)12-14-11-15(25-2)6-10-20-14/h6,10-11,13,19H,3-5,7-9,12H2,1-2H3,(H,21,24)
InChIKeyMOZCWKSWWWKSMM-UHFFFAOYSA-N
MW346.43 g/mol
LogP1.68
Rot. Bonds6

About 3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione

3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione (PubChem CID 56713349) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is 3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione
PubChem CID56713349
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC Name3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione
SMILESCCCC1(C2CCNCC2)NC(=O)N(Cc2cc(OC)ccn2)C1=O
InChIInChI=1S/C18H26N4O3/c1-3-7-18(13-4-8-19-9-5-13)16(23)22(17(24)21-18)12-14-11-15(25-2)6-10-20-14/h6,10-11,13,19H,3-5,7-9,12H2,1-2H3,(H,21,24)
InChIKeyMOZCWKSWWWKSMM-UHFFFAOYSA-N
XLogP1.68
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione with MolForge

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Related Compounds

(5S)-3-[(5-methoxy-4-oxopyran-2-yl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione
CID 95226226
(5R)-3-[(2-fluoro-5-methylphenyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione
CID 95219274
(5R)-3-[2-(2-ethylimidazol-1-yl)ethyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione
CID 95206967
(5R)-3-(4-fluorobutyl)-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione
CID 95219594
5-(2-phenylethyl)-5-piperidin-4-yl-3-(pyrazin-2-ylmethyl)imidazolidine-2,4-dione
CID 56710057
(5R)-3-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione
CID 95204092
(5R)-3-(3-hydroxypropyl)-5-[(3-methoxyphenyl)methyl]-5-piperidin-4-ylimidazolidine-2,4-dione
CID 95210352
4-[2-[(4R)-2,5-dioxo-4-piperidin-4-yl-4-propylimidazolidin-1-yl]ethyl]benzonitrile
CID 95223916
3-[(3,5-dimethoxyphenyl)methyl]-5-methyl-5-piperidin-4-ylimidazolidine-2,4-dione;hydrochloride
CID 154892305
5-[1-[(3,5-dimethoxyphenyl)methyl]piperidin-4-yl]-3-(oxolan-2-ylmethyl)-5-propylimidazolidine-2,4-dione
CID 45182219
5-[(4-fluorophenyl)methyl]-3-[(2-methyl-1,3-oxazol-4-yl)methyl]-5-piperidin-4-ylimidazolidine-2,4-dione
CID 56723279
5-[1-(3-fluoro-4-methoxybenzoyl)piperidin-4-yl]-5-propyl-3-(2-pyridin-2-ylethyl)imidazolidine-2,4-dione
CID 45206964

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione?
The IUPAC name of 3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione (CID 56713349) is 3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione?
The canonical SMILES for 3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione is CCCC1(C2CCNCC2)NC(=O)N(Cc2cc(OC)ccn2)C1=O.
What is the InChIKey of 3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione?
The InChIKey is MOZCWKSWWWKSMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c1-3-7-18(13-4-8-19-9-5-13)16(23)22(17(24)21-18)12-14-11-15(25-2)6-10-20-14/h6,10-11,13,19H,3-5,7-9,12H2,1-2H3,(H,21,24).
What are the key properties of 3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione?
3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione has a molecular weight of 346.43 g/mol, XLogP of 1.68, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methoxy-2-pyridinyl)methyl]-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione is sourced from PubChem (CID 56713349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).