N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide

C13H20N4O2 — CID 136878687

IUPACN-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
SMILESO=C(NC1CCC(O)CC1)c1cn2c(n1)NCCC2
InChIInChI=1S/C13H20N4O2/c18-10-4-2-9(3-5-10)15-12(19)11-8-17-7-1-6-14-13(17)16-11/h8-10,18H,1-7H2,(H,14,16)(H,15,19)
InChIKeyDYABGEQVTZKDFA-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.73
Rot. Bonds2

About N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide

N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide (PubChem CID 136878687) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
PubChem CID136878687
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
SMILESO=C(NC1CCC(O)CC1)c1cn2c(n1)NCCC2
InChIInChI=1S/C13H20N4O2/c18-10-4-2-9(3-5-10)15-12(19)11-8-17-7-1-6-14-13(17)16-11/h8-10,18H,1-7H2,(H,14,16)(H,15,19)
InChIKeyDYABGEQVTZKDFA-UHFFFAOYSA-N
XLogP0.73
TPSA79.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-oxothian-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136879236
N-(1-methylpyrrolidin-3-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136879092
N-(3,3-dimethylcyclopentyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136879232
N-(1-azabicyclo[2.2.2]octan-3-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136745665
N-(2,3-dimethylcyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136878699
N-(1-methyl-2,5-dioxopyrrolidin-3-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136745702
N-(2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136878676
N-(4-methyloxan-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136879212
N-[3-(2-methylpropoxy)propyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136878757
N-(5-fluoro-2-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136878680
N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136994527
N-(2,5-dimethylpyrazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
CID 136878897

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide (CID 136878687) is N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide is O=C(NC1CCC(O)CC1)c1cn2c(n1)NCCC2.
What is the InChIKey of N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide?
The InChIKey is DYABGEQVTZKDFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c18-10-4-2-9(3-5-10)15-12(19)11-8-17-7-1-6-14-13(17)16-11/h8-10,18H,1-7H2,(H,14,16)(H,15,19).
What are the key properties of N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide?
N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.73, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 136878687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).