N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C15H21N5O4S — CID 135119015

IUPACN-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)N[C@H]3COC[C@H]3CS(=O)(=O)N(C)C)cnn2c1
InChIInChI=1S/C15H21N5O4S/c1-10-4-16-14-12(5-17-20(14)6-10)15(21)18-13-8-24-7-11(13)9-25(22,23)19(2)3/h4-6,11,13H,7-9H2,1-3H3,(H,18,21)/t11-,13-/m0/s1
InChIKeyDSKCYIZLCZCEPN-AAEUAGOBSA-N
MW367.43 g/mol
LogP-0.33
Rot. Bonds5

About N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 135119015) has the molecular formula C15H21N5O4S and a molecular weight of 367.43 g/mol. Its IUPAC name is N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID135119015
Molecular FormulaC15H21N5O4S
Molecular Weight367.43 g/mol
Exact Mass367.13
IUPAC NameN-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)N[C@H]3COC[C@H]3CS(=O)(=O)N(C)C)cnn2c1
InChIInChI=1S/C15H21N5O4S/c1-10-4-16-14-12(5-17-20(14)6-10)15(21)18-13-8-24-7-11(13)9-25(22,23)19(2)3/h4-6,11,13H,7-9H2,1-3H3,(H,18,21)/t11-,13-/m0/s1
InChIKeyDSKCYIZLCZCEPN-AAEUAGOBSA-N
XLogP-0.33
TPSA105.90 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.43
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyridine-3-carboxamide
CID 156583849
N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2,3-dimethylimidazo[4,5-b]pyridine-7-carboxamide
CID 157017466
N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-1-ethylpyrazole-4-carboxamide
CID 135096220
N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2,6-dimethylpyridine-3-carboxamide
CID 135095221
N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]quinoxaline-5-carboxamide
CID 135091371
N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-3-hydroxy-2-methylbenzamide
CID 135090735
4-chloro-N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-1-methylpyrazole-3-carboxamide
CID 135119969
N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2,4,5-trifluorobenzamide
CID 135094558
N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2-fluoro-3-methylbenzamide
CID 135091177
N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-5-ethyl-1,3-oxazole-4-carboxamide
CID 135115806
N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-5-ethyl-1,3-oxazole-4-carboxamide
CID 135115737
N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-5-hydroxy-2-methylbenzamide
CID 135103380

Frequently Asked Questions

What is the IUPAC name of N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 135119015) is N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cnc2c(C(=O)N[C@H]3COC[C@H]3CS(=O)(=O)N(C)C)cnn2c1.
What is the InChIKey of N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is DSKCYIZLCZCEPN-AAEUAGOBSA-N. The full InChI is InChI=1S/C15H21N5O4S/c1-10-4-16-14-12(5-17-20(14)6-10)15(21)18-13-8-24-7-11(13)9-25(22,23)19(2)3/h4-6,11,13H,7-9H2,1-3H3,(H,18,21)/t11-,13-/m0/s1.
What are the key properties of N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 367.43 g/mol, XLogP of -0.33, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 135119015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).