7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C18H21N7O2 — CID 142523921

IUPAC7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnn2c(N)cc(Nc3cccn(C4CCCCC4)c3=O)nc12
InChIInChI=1S/C18H21N7O2/c19-14-9-15(23-17-12(16(20)26)10-21-25(14)17)22-13-7-4-8-24(18(13)27)11-5-2-1-3-6-11/h4,7-11H,1-3,5-6,19H2,(H2,20,26)(H,22,23)
InChIKeyCUUZPXWSWYKDKX-UHFFFAOYSA-N
MW367.41 g/mol
LogP1.82
Rot. Bonds4

About 7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide

7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 142523921) has the molecular formula C18H21N7O2 and a molecular weight of 367.41 g/mol. Its IUPAC name is 7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID142523921
Molecular FormulaC18H21N7O2
Molecular Weight367.41 g/mol
Exact Mass367.18
IUPAC Name7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnn2c(N)cc(Nc3cccn(C4CCCCC4)c3=O)nc12
InChIInChI=1S/C18H21N7O2/c19-14-9-15(23-17-12(16(20)26)10-21-25(14)17)22-13-7-4-8-24(18(13)27)11-5-2-1-3-6-11/h4,7-11H,1-3,5-6,19H2,(H2,20,26)(H,22,23)
InChIKeyCUUZPXWSWYKDKX-UHFFFAOYSA-N
XLogP1.82
TPSA133.33 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 51.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 142523921) is 7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide is NC(=O)c1cnn2c(N)cc(Nc3cccn(C4CCCCC4)c3=O)nc12.
What is the InChIKey of 7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is CUUZPXWSWYKDKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N7O2/c19-14-9-15(23-17-12(16(20)26)10-21-25(14)17)22-13-7-4-8-24(18(13)27)11-5-2-1-3-6-11/h4,7-11H,1-3,5-6,19H2,(H2,20,26)(H,22,23).
What are the key properties of 7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 367.41 g/mol, XLogP of 1.82, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-5-[(1-cyclohexyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 142523921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).