2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide

C16H24N4O2 — CID 135143345

IUPAC2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide
SMILESCNC(=O)N1C(C(C)(C)C)N(C)C(=O)C1(C)c1cccnc1
InChIInChI=1S/C16H24N4O2/c1-15(2,3)12-19(6)13(21)16(4,20(12)14(22)17-5)11-8-7-9-18-10-11/h7-10,12H,1-6H3,(H,17,22)
InChIKeySCJNXMJPNWEFOR-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.78
Rot. Bonds1

About 2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide

2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide (PubChem CID 135143345) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide.

Molecular Properties

Compound Name2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide
PubChem CID135143345
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC Name2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide
SMILESCNC(=O)N1C(C(C)(C)C)N(C)C(=O)C1(C)c1cccnc1
InChIInChI=1S/C16H24N4O2/c1-15(2,3)12-19(6)13(21)16(4,20(12)14(22)17-5)11-8-7-9-18-10-11/h7-10,12H,1-6H3,(H,17,22)
InChIKeySCJNXMJPNWEFOR-UHFFFAOYSA-N
XLogP1.78
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Kdoam-29
CID 126961673
5-Phenyl-3-(3-pyridinylmethyl)-5-(trifluoromethyl)-2,4-imidazolidinedione
CID 2968088
N-[2,5-dioxo-1-(pyridin-3-ylmethyl)-4-(trifluoromethyl)imidazolidin-4-yl]-4-fluorobenzamide
CID 4325939
1-Phenyl-8-pyridin-3-ylmethyl-1,3,8-triaza-spiro[4.5]decan-4-one
CID 9797246
(2S)-1-(3,3-dimethyl-2-oxopentanoyl)-N-(3-pyridin-3-ylpropyl)pyrrolidine-2-carboxamide
CID 9798937
1-Phenyl-8-pyridin-2-ylmethyl-1,3,8-triaza-spiro[4.5]decan-4-one
CID 24735827
3,5-Dimethyl-3,5,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),10,12-triene-4,6-dione
CID 44457469
1-Phenyl-8-(1-(pyridin-4-ylmethyl)piperidine-4-carbonyl)-1,3,8-triazaspiro[4.5]decan-4-one
CID 49864795
N-[[6-(3-methylbutanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide
CID 118621295
5-Methyl-5-(4-pyridyl)hydantoin
CID 222702
acs.jmedchem.1c00409_ST.437
CID 71717909
N-[2,5-dioxo-1-(3-pyridinylmethyl)-4-(trifluoromethyl)-4-imidazolidinyl]benzamide
CID 2962133

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide?
The IUPAC name of 2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide (CID 135143345) is 2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide.
What is the SMILES notation for 2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide?
The canonical SMILES for 2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide is CNC(=O)N1C(C(C)(C)C)N(C)C(=O)C1(C)c1cccnc1.
What is the InChIKey of 2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide?
The InChIKey is SCJNXMJPNWEFOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-15(2,3)12-19(6)13(21)16(4,20(12)14(22)17-5)11-8-7-9-18-10-11/h7-10,12H,1-6H3,(H,17,22).
What are the key properties of 2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide?
2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-N,3,5-trimethyl-4-oxo-5-pyridin-3-ylimidazolidine-1-carboxamide is sourced from PubChem (CID 135143345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).