1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone

C14H23N5O — CID 12763790

IUPAC1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone
SMILESCC(=O)N1CCN=C1Nc1cc(C(C)C)nn1C(C)C
InChIInChI=1S/C14H23N5O/c1-9(2)12-8-13(19(17-12)10(3)4)16-14-15-6-7-18(14)11(5)20/h8-10H,6-7H2,1-5H3,(H,15,16)
InChIKeyRZGBVSPSFCHEGV-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.22
Rot. Bonds3

About 1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone

1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone (PubChem CID 12763790) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone.

Molecular Properties

Compound Name1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone
PubChem CID12763790
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone
SMILESCC(=O)N1CCN=C1Nc1cc(C(C)C)nn1C(C)C
InChIInChI=1S/C14H23N5O/c1-9(2)12-8-13(19(17-12)10(3)4)16-14-15-6-7-18(14)11(5)20/h8-10H,6-7H2,1-5H3,(H,15,16)
InChIKeyRZGBVSPSFCHEGV-UHFFFAOYSA-N
XLogP2.22
TPSA62.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone with MolForge

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Related Compounds

N-butyl-1-(3-tert-butyl-1-methylpyrazol-5-yl)-2-methyl-5-oxopyrrolidine-2-carboxamide
CID 51361550
2-(5-amino-3-cyclopropyl-1H-pyrazol-1-yl)-6-isopropylpyrimidin-4(3H)-one
CID 135984534
2-(5-amino-3-cyclopropyl-1H-pyrazol-1-yl)-6-propylpyrimidin-4(3H)-one
CID 135984533
1-Butyl-3-(3-tert-butyl-1-methylpyrazol-5-yl)urea
CID 2811754
6-tert-butyl-1H,2H,3H-pyrazolo[1,5-a]imidazol-2-one
CID 135741967
N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(2-oxo-1-pyridinyl)acetamide
CID 45795795
N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]-6-oxo-1H-pyridazine-3-carboxamide
CID 49217836
1-(3-tert-butyl-1-methylpyrazol-5-yl)-N-cyclopentyl-2-methyl-5-oxopyrrolidine-2-carboxamide
CID 51361546
N-(3-tert-butyl-1-methyl-1H-pyrazol-5-yl)acetamide
CID 6489269
N-(3-cyclopropyl-1-methylpyrazol-5-yl)acetamide
CID 89327754
N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methylpropanamide
CID 91529109
2-(5-Amino-3-tert-butyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4(3H)-one
CID 135876306

Frequently Asked Questions

What is the IUPAC name of 1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone?
The IUPAC name of 1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone (CID 12763790) is 1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone.
What is the SMILES notation for 1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone?
The canonical SMILES for 1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone is CC(=O)N1CCN=C1Nc1cc(C(C)C)nn1C(C)C.
What is the InChIKey of 1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone?
The InChIKey is RZGBVSPSFCHEGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-9(2)12-8-13(19(17-12)10(3)4)16-14-15-6-7-18(14)11(5)20/h8-10H,6-7H2,1-5H3,(H,15,16).
What are the key properties of 1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone?
1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone has a molecular weight of 277.37 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[1,3-di(propan-2-yl)pyrazol-5-yl]amino]-4,5-dihydroimidazol-1-yl]ethanone is sourced from PubChem (CID 12763790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).