N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide

C17H13N5O2 — CID 71601789

IUPACN-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide
SMILESCc1nc(NC(=O)c2ccco2)c2nn(-c3ccccc3)cc2n1
InChIInChI=1S/C17H13N5O2/c1-11-18-13-10-22(12-6-3-2-4-7-12)21-15(13)16(19-11)20-17(23)14-8-5-9-24-14/h2-10H,1H3,(H,18,19,20,23)
InChIKeyCIDDCEIACLQQTP-UHFFFAOYSA-N
MW319.32 g/mol
LogP2.97
Rot. Bonds3

About N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide

N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide (PubChem CID 71601789) has the molecular formula C17H13N5O2 and a molecular weight of 319.32 g/mol. Its IUPAC name is N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide
PubChem CID71601789
Molecular FormulaC17H13N5O2
Molecular Weight319.32 g/mol
Exact Mass319.11
IUPAC NameN-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide
SMILESCc1nc(NC(=O)c2ccco2)c2nn(-c3ccccc3)cc2n1
InChIInChI=1S/C17H13N5O2/c1-11-18-13-10-22(12-6-3-2-4-7-12)21-15(13)16(19-11)20-17(23)14-8-5-9-24-14/h2-10H,1H3,(H,18,19,20,23)
InChIKeyCIDDCEIACLQQTP-UHFFFAOYSA-N
XLogP2.97
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.32
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-(furan-2-yl)-6-(1H-pyrazol-1-yl)pyrimidin-4-yl)-2-(4-methylpiperazin-1-yl)acetamide
CID 11956193
N-(6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl)-2-(4-methylpiperazin-1-yl)acetamide
CID 24768401
N-[6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(5-methylfuran-2-yl)pyrimidin-4-yl]-2-(morpholin-4-yl)acetamide
CID 24768420
N-[3-(1-ethyl-1H-benzimidazol-2-yl)propyl]furan-2-carboxamide
CID 3164555
1-[4-(Furan-2-yl)-11-methyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,9-pentaen-7-yl]-3-pyridin-4-ylurea;hydrochloride
CID 9887858
5-[[(4-Pyridyl)-amino]carbonyl]amino-8-methyl-2-(2-furyl)-pyrazolo[4,3-e]-1,2,4-triazolo[1,5-c]pyrimidine
CID 9887859
1-[4-(Furan-2-yl)-11-methyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,9-pentaen-7-yl]-3-phenylurea
CID 9929470
1-(8-Butyl-2-furan-2-yl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)-3-phenyl-urea
CID 10905799
N-(2-furan-2-yl-6-pyrazol-1-yl-pyrimidin-4-yl)-acetamide
CID 11380183
8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazine-6-carboxylic acid butylamide
CID 11652346
1-(2-(furan-2-yl)-8-propyl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)-3-phenylurea
CID 11761221
N-[1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]furan-2-carboxamide
CID 938552

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide?
The IUPAC name of N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide (CID 71601789) is N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide.
What is the SMILES notation for N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide?
The canonical SMILES for N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide is Cc1nc(NC(=O)c2ccco2)c2nn(-c3ccccc3)cc2n1.
What is the InChIKey of N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide?
The InChIKey is CIDDCEIACLQQTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5O2/c1-11-18-13-10-22(12-6-3-2-4-7-12)21-15(13)16(19-11)20-17(23)14-8-5-9-24-14/h2-10H,1H3,(H,18,19,20,23).
What are the key properties of N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide?
N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide has a molecular weight of 319.32 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-phenylpyrazolo[4,3-d]pyrimidin-7-yl)furan-2-carboxamide is sourced from PubChem (CID 71601789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).