5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide

C14H19N5O — CID 97118223

IUPAC5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide
SMILESCCCc1cc(C(=O)N[C@H](C)Cc2cnccn2)n[nH]1
InChIInChI=1S/C14H19N5O/c1-3-4-11-8-13(19-18-11)14(20)17-10(2)7-12-9-15-5-6-16-12/h5-6,8-10H,3-4,7H2,1-2H3,(H,17,20)(H,18,19)/t10-/m1/s1
InChIKeyJOPQJZBFOQGYHY-SNVBAGLBSA-N
MW273.34 g/mol
LogP1.51
Rot. Bonds6

About 5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide

5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide (PubChem CID 97118223) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide
PubChem CID97118223
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide
SMILESCCCc1cc(C(=O)N[C@H](C)Cc2cnccn2)n[nH]1
InChIInChI=1S/C14H19N5O/c1-3-4-11-8-13(19-18-11)14(20)17-10(2)7-12-9-15-5-6-16-12/h5-6,8-10H,3-4,7H2,1-2H3,(H,17,20)(H,18,19)/t10-/m1/s1
InChIKeyJOPQJZBFOQGYHY-SNVBAGLBSA-N
XLogP1.51
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 55717161
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5-methyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrazine-2-carboxamide
CID 91779730
(2S)-3-methyl-2-[(5-propyl-1H-pyrazole-3-carbonyl)amino]butanoic acid
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N-[(2S)-1-imidazol-1-yl-3-methylbutan-2-yl]-5-propyl-1H-pyrazole-3-carboxamide
CID 94612533
3-[3-(dimethylamino)-1H-1,2,4-triazol-5-yl]-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]benzamide
CID 125160027
N-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-6-oxo-1H-pyrazine-3-carboxamide
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4-(difluoromethoxy)-N-(1-pyrazin-2-ylpropan-2-yl)benzamide
CID 90653962
4-methyl-2-propan-2-yl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide
CID 97129067
2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide
CID 99954745
2-(phenoxymethyl)-N-(1-pyrazin-2-ylpropan-2-yl)-1,3-oxazole-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide (CID 97118223) is 5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide is CCCc1cc(C(=O)N[C@H](C)Cc2cnccn2)n[nH]1.
What is the InChIKey of 5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide?
The InChIKey is JOPQJZBFOQGYHY-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H19N5O/c1-3-4-11-8-13(19-18-11)14(20)17-10(2)7-12-9-15-5-6-16-12/h5-6,8-10H,3-4,7H2,1-2H3,(H,17,20)(H,18,19)/t10-/m1/s1.
What are the key properties of 5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide?
5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 1.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 97118223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).