1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide

C19H26N6O — CID 97150133

IUPAC1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide
SMILESCC[C@@H](NC(=O)c1cc(CC(C)C)nn1CC)c1cn2cccnc2n1
InChIInChI=1S/C19H26N6O/c1-5-15(16-12-24-9-7-8-20-19(24)22-16)21-18(26)17-11-14(10-13(3)4)23-25(17)6-2/h7-9,11-13,15H,5-6,10H2,1-4H3,(H,21,26)/t15-/m1/s1
InChIKeyOLHMGYUCZPBDJI-OAHLLOKOSA-N
MW354.46 g/mol
LogP3.03
Rot. Bonds7

About 1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide

1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide (PubChem CID 97150133) has the molecular formula C19H26N6O and a molecular weight of 354.46 g/mol. Its IUPAC name is 1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide
PubChem CID97150133
Molecular FormulaC19H26N6O
Molecular Weight354.46 g/mol
Exact Mass354.22
IUPAC Name1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide
SMILESCC[C@@H](NC(=O)c1cc(CC(C)C)nn1CC)c1cn2cccnc2n1
InChIInChI=1S/C19H26N6O/c1-5-15(16-12-24-9-7-8-20-19(24)22-16)21-18(26)17-11-14(10-13(3)4)23-25(17)6-2/h7-9,11-13,15H,5-6,10H2,1-4H3,(H,21,26)/t15-/m1/s1
InChIKeyOLHMGYUCZPBDJI-OAHLLOKOSA-N
XLogP3.03
TPSA77.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.46
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-chloro-N-[(1S)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]thiophene-2-carboxamide
CID 99973548
N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-4-methyl-2-propan-2-yl-1,3-thiazole-5-carboxamide
CID 72916676
N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 99973207
N-[(1S)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 97133513
5-ethoxy-N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)furan-2-carboxamide
CID 90653702
3-amino-4-chloro-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-1H-pyrazole-5-carboxamide
CID 99933087
N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-2-pyrrolidin-1-ylpropanamide
CID 126436371
1-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-3-(1-propyltriazol-4-yl)urea
CID 72879096
1-ethyl-3-(2-methylpropyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]pyrazole-5-carboxamide
CID 97110787
N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-d][1,4]diazepine-2-carboxamide;dihydrochloride
CID 155938444
1-(4-aminocyclohexyl)-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]triazole-4-carboxamide
CID 98308001
N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 90651651

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide?
The IUPAC name of 1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide (CID 97150133) is 1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide.
What is the SMILES notation for 1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide?
The canonical SMILES for 1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide is CC[C@@H](NC(=O)c1cc(CC(C)C)nn1CC)c1cn2cccnc2n1.
What is the InChIKey of 1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide?
The InChIKey is OLHMGYUCZPBDJI-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H26N6O/c1-5-15(16-12-24-9-7-8-20-19(24)22-16)21-18(26)17-11-14(10-13(3)4)23-25(17)6-2/h7-9,11-13,15H,5-6,10H2,1-4H3,(H,21,26)/t15-/m1/s1.
What are the key properties of 1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide?
1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide has a molecular weight of 354.46 g/mol, XLogP of 3.03, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-3-(2-methylpropyl)pyrazole-5-carboxamide is sourced from PubChem (CID 97150133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).