N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide

C15H13FN4O2 — CID 110899057

IUPACN-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide
SMILESO=C(NCC(O)c1ccc(F)cc1)c1cn2cccnc2n1
InChIInChI=1S/C15H13FN4O2/c16-11-4-2-10(3-5-11)13(21)8-18-14(22)12-9-20-7-1-6-17-15(20)19-12/h1-7,9,13,21H,8H2,(H,18,22)
InChIKeyMXCZWRRDOMSOBL-UHFFFAOYSA-N
MW300.29 g/mol
LogP1.33
Rot. Bonds4

About N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide

N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide (PubChem CID 110899057) has the molecular formula C15H13FN4O2 and a molecular weight of 300.29 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide
PubChem CID110899057
Molecular FormulaC15H13FN4O2
Molecular Weight300.29 g/mol
Exact Mass300.10
IUPAC NameN-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide
SMILESO=C(NCC(O)c1ccc(F)cc1)c1cn2cccnc2n1
InChIInChI=1S/C15H13FN4O2/c16-11-4-2-10(3-5-11)13(21)8-18-14(22)12-9-20-7-1-6-17-15(20)19-12/h1-7,9,13,21H,8H2,(H,18,22)
InChIKeyMXCZWRRDOMSOBL-UHFFFAOYSA-N
XLogP1.33
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.29
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(furan-2-yl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide
CID 110899099
N-(3-hydroxy-3-phenylpropyl)imidazo[1,2-a]pyrimidine-2-carboxamide
CID 111472086
N-[2-(4-fluorophenyl)-2-hydroxyethyl]pyridine-2-carboxamide
CID 86980947
N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]imidazo[1,2-a]pyrimidine-2-carboxamide
CID 75479772
N-(4-hydroxy-2,2-dimethylpentyl)imidazo[1,2-a]pyrimidine-2-carboxamide
CID 111480679
1-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]triazole-4-carboxamide
CID 110922720
N-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]imidazo[1,2-a]pyrimidine-2-carboxamide
CID 74235431
methyl (2S)-2-(2,5-difluorophenyl)-2-(imidazo[1,2-a]pyrimidine-2-carbonylamino)acetate
CID 94823473
N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]imidazo[1,2-a]pyrimidine-2-carboxamide
CID 146264054
tert-butyl N-[(2S)-3-(imidazo[1,2-a]pyrimidine-2-carbonylamino)-2-methylpropyl]-N-methylcarbamate
CID 95621544
N-[2-(cycloheptylamino)ethyl]imidazo[1,2-a]pyrimidine-2-carboxamide
CID 99712859
N-[2-(4-tert-butylphenyl)-2-hydroxyethyl]pyridine-2-carboxamide
CID 111422570

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
The IUPAC name of N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide (CID 110899057) is N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide is O=C(NCC(O)c1ccc(F)cc1)c1cn2cccnc2n1.
What is the InChIKey of N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
The InChIKey is MXCZWRRDOMSOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4O2/c16-11-4-2-10(3-5-11)13(21)8-18-14(22)12-9-20-7-1-6-17-15(20)19-12/h1-7,9,13,21H,8H2,(H,18,22).
What are the key properties of N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide?
N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide has a molecular weight of 300.29 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazo[1,2-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 110899057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).