N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide

C17H18N4O2 — CID 53040846

IUPACN-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCOc1cccc(NC(=O)c2cc(C(C)C)n3nccc3n2)c1
InChIInChI=1S/C17H18N4O2/c1-11(2)15-10-14(20-16-7-8-18-21(15)16)17(22)19-12-5-4-6-13(9-12)23-3/h4-11H,1-3H3,(H,19,22)
InChIKeyFYCAIRTWSPJWMG-UHFFFAOYSA-N
MW310.36 g/mol
LogP3.11
Rot. Bonds4

About N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide

N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 53040846) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID53040846
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC NameN-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCOc1cccc(NC(=O)c2cc(C(C)C)n3nccc3n2)c1
InChIInChI=1S/C17H18N4O2/c1-11(2)15-10-14(20-16-7-8-18-21(15)16)17(22)19-12-5-4-6-13(9-12)23-3/h4-11H,1-3H3,(H,19,22)
InChIKeyFYCAIRTWSPJWMG-UHFFFAOYSA-N
XLogP3.11
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-phenyl-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 53040898
N-(2-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 53040848
6-N-(3-methoxyphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099989
6-(3-methoxyanilino)-N-(3-methoxyphenyl)-2-methylpyrimidine-4-carboxamide
CID 112850479
6-(4-methoxyanilino)-N-(3-methoxyphenyl)-2-methylpyrimidine-4-carboxamide
CID 112850511
N-(3-methoxyphenyl)-2-methyl-6-(3-methylbutylamino)pyrimidine-4-carboxamide
CID 112846528
N-(3-methoxyphenyl)isoquinoline-3-carboxamide
CID 110859992
N-(3-methoxyphenyl)-6-(4-propan-2-ylanilino)pyridazine-3-carboxamide
CID 109128208
N-(3-methoxyphenyl)-4-propan-2-ylbenzamide
CID 897049
4-amino-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 55041968
N-(3-methoxyphenyl)-1,5-dimethylpyrazole-3-carboxamide
CID 19279593
N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 55042566

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 53040846) is N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide is COc1cccc(NC(=O)c2cc(C(C)C)n3nccc3n2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is FYCAIRTWSPJWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-11(2)15-10-14(20-16-7-8-18-21(15)16)17(22)19-12-5-4-6-13(9-12)23-3/h4-11H,1-3H3,(H,19,22).
What are the key properties of N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 310.36 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-7-propan-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 53040846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).