2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide

C7H13N3O2 — CID 162487765

IUPAC2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide
SMILESCC(C)N1C=C(C(N)=O)NC1O
InChIInChI=1S/C7H13N3O2/c1-4(2)10-3-5(6(8)11)9-7(10)12/h3-4,7,9,12H,1-2H3,(H2,8,11)
InChIKeyRWHSBNCDDITQQF-UHFFFAOYSA-N
MW171.20 g/mol
LogP-1.10
Rot. Bonds2

About 2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide

2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide (PubChem CID 162487765) has the molecular formula C7H13N3O2 and a molecular weight of 171.20 g/mol. Its IUPAC name is 2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide.

Molecular Properties

Compound Name2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide
PubChem CID162487765
Molecular FormulaC7H13N3O2
Molecular Weight171.20 g/mol
Exact Mass171.10
IUPAC Name2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide
SMILESCC(C)N1C=C(C(N)=O)NC1O
InChIInChI=1S/C7H13N3O2/c1-4(2)10-3-5(6(8)11)9-7(10)12/h3-4,7,9,12H,1-2H3,(H2,8,11)
InChIKeyRWHSBNCDDITQQF-UHFFFAOYSA-N
XLogP-1.10
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 5-1.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

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2-(1-propan-2-ylpiperidin-4-yl)-1H-benzimidazole-4-carboxamide
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4-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]benzamide
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1-propan-2-yl-1,2,4-triazole-3-carboxamide
CID 20680311
2-hydroxy-3-pentan-3-yl-1,2-dihydropyrimidin-6-one
CID 90854752
1H-indazole-3-carboxamide;(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octane
CID 67338966
5-butan-2-yl-1H-imidazole-2-carboxamide
CID 126495888
2-(6-methyl-3,5-dioxo-1,2,4-triazin-2-yl)propanamide
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3-oxo-4-propan-2-yl-1,2-dihydropyrazine-2-carboxamide
CID 137411127
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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide?
The IUPAC name of 2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide (CID 162487765) is 2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide.
What is the SMILES notation for 2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide?
The canonical SMILES for 2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide is CC(C)N1C=C(C(N)=O)NC1O.
What is the InChIKey of 2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide?
The InChIKey is RWHSBNCDDITQQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2/c1-4(2)10-3-5(6(8)11)9-7(10)12/h3-4,7,9,12H,1-2H3,(H2,8,11).
What are the key properties of 2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide?
2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide has a molecular weight of 171.20 g/mol, XLogP of -1.10, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide is sourced from PubChem (CID 162487765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).