7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide

C18H24N4O3 — CID 91781697

IUPAC7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCc1c(C(=O)N[C@H]2CCOC[C@H]2C2CCOCC2)cnc2ccnn12
InChIInChI=1S/C18H24N4O3/c1-12-14(10-19-17-2-6-20-22(12)17)18(23)21-16-5-9-25-11-15(16)13-3-7-24-8-4-13/h2,6,10,13,15-16H,3-5,7-9,11H2,1H3,(H,21,23)/t15-,16-/m0/s1
InChIKeyDLLMUFKQHVYKIZ-HOTGVXAUSA-N
MW344.42 g/mol
LogP1.60
Rot. Bonds3

About 7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide

7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide (PubChem CID 91781697) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is 7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
PubChem CID91781697
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC Name7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCc1c(C(=O)N[C@H]2CCOC[C@H]2C2CCOCC2)cnc2ccnn12
InChIInChI=1S/C18H24N4O3/c1-12-14(10-19-17-2-6-20-22(12)17)18(23)21-16-5-9-25-11-15(16)13-3-7-24-8-4-13/h2,6,10,13,15-16H,3-5,7-9,11H2,1H3,(H,21,23)/t15-,16-/m0/s1
InChIKeyDLLMUFKQHVYKIZ-HOTGVXAUSA-N
XLogP1.60
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide with MolForge

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Related Compounds

7-methyl-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 118770888
2-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]-1-benzofuran-7-carboxamide
CID 91776897
2,6-dimethyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrimidine-4-carboxamide
CID 91795988
1-ethyl-3,5-dimethyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazole-4-carboxamide
CID 91797549
2,4-dimethoxy-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]benzamide
CID 91794863
(7-methylpyrazolo[1,5-a]pyrimidin-6-yl)-[(1S,5R)-3-(oxan-4-yl)-3,6-diazabicyclo[3.2.2]nonan-6-yl]methanone
CID 70758827
2-butoxy-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]benzamide
CID 91774099
5-methyl-N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2H-triazole-4-carboxamide
CID 133266154
N-[(3S,7R,8aS)-3-phenyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-7-yl]-7-methylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 155495814
N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-7-methylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 95713609
N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide
CID 133267139
N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]naphthalene-2-carboxamide
CID 133265512

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The IUPAC name of 7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide (CID 91781697) is 7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The canonical SMILES for 7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide is Cc1c(C(=O)N[C@H]2CCOC[C@H]2C2CCOCC2)cnc2ccnn12.
What is the InChIKey of 7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The InChIKey is DLLMUFKQHVYKIZ-HOTGVXAUSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-12-14(10-19-17-2-6-20-22(12)17)18(23)21-16-5-9-25-11-15(16)13-3-7-24-8-4-13/h2,6,10,13,15-16H,3-5,7-9,11H2,1H3,(H,21,23)/t15-,16-/m0/s1.
What are the key properties of 7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide?
7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]pyrazolo[1,5-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 91781697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).