N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide

C16H24N6O — CID 50974325

IUPACN-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide
SMILESCCn1nc(C)c(NC(=O)CNC(C)Cc2cnccn2)c1C
InChIInChI=1S/C16H24N6O/c1-5-22-13(4)16(12(3)21-22)20-15(23)10-19-11(2)8-14-9-17-6-7-18-14/h6-7,9,11,19H,5,8,10H2,1-4H3,(H,20,23)
InChIKeyHKEFIRYGJHSYTL-UHFFFAOYSA-N
MW316.41 g/mol
LogP1.47
Rot. Bonds7

About N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide

N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide (PubChem CID 50974325) has the molecular formula C16H24N6O and a molecular weight of 316.41 g/mol. Its IUPAC name is N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide
PubChem CID50974325
Molecular FormulaC16H24N6O
Molecular Weight316.41 g/mol
Exact Mass316.20
IUPAC NameN-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide
SMILESCCn1nc(C)c(NC(=O)CNC(C)Cc2cnccn2)c1C
InChIInChI=1S/C16H24N6O/c1-5-22-13(4)16(12(3)21-22)20-15(23)10-19-11(2)8-14-9-17-6-7-18-14/h6-7,9,11,19H,5,8,10H2,1-4H3,(H,20,23)
InChIKeyHKEFIRYGJHSYTL-UHFFFAOYSA-N
XLogP1.47
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[[(2R)-1-thiophen-2-ylpropan-2-yl]amino]acetamide
CID 95125451
2-amino-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide;hydrochloride
CID 130639181
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide
CID 91843220
5-methyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrazine-2-carboxamide
CID 91779730
2-(1-ethylpiperidin-4-yl)-N-(1-pyrazin-2-ylpropan-2-yl)acetamide
CID 72847502
(2R)-2-[[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]amino]propanoic acid
CID 83193828
4,6-dimethyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]pyrimidin-2-amine
CID 95129567
5,8-dimethyl-2-[(1-pyrazin-2-ylpropan-2-ylamino)methyl]-1H-quinolin-4-one
CID 72876833
N-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethyl]-3-pyrazin-2-ylpropanamide
CID 118794340
2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide
CID 99954745
4-methyl-2-propan-2-yl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide
CID 97129067
3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-1-methyl-1-[(1S)-1-pyridin-3-ylpentyl]urea
CID 97436636

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide?
The IUPAC name of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide (CID 50974325) is N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide.
What is the SMILES notation for N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide?
The canonical SMILES for N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide is CCn1nc(C)c(NC(=O)CNC(C)Cc2cnccn2)c1C.
What is the InChIKey of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide?
The InChIKey is HKEFIRYGJHSYTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N6O/c1-5-22-13(4)16(12(3)21-22)20-15(23)10-19-11(2)8-14-9-17-6-7-18-14/h6-7,9,11,19H,5,8,10H2,1-4H3,(H,20,23).
What are the key properties of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide?
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide has a molecular weight of 316.41 g/mol, XLogP of 1.47, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide is sourced from PubChem (CID 50974325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).