3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide

C18H19N5O2 — CID 67064544

IUPAC3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide
SMILESCc1cccc(C(=O)Nc2cc(N3CCOCC3)n3nccc3n2)c1
InChIInChI=1S/C18H19N5O2/c1-13-3-2-4-14(11-13)18(24)21-15-12-17(22-7-9-25-10-8-22)23-16(20-15)5-6-19-23/h2-6,11-12H,7-10H2,1H3,(H,20,21,24)
InChIKeyMZULRRJWWYWGJJ-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.13
Rot. Bonds3

About 3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide

3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide (PubChem CID 67064544) has the molecular formula C18H19N5O2 and a molecular weight of 337.38 g/mol. Its IUPAC name is 3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide.

Molecular Properties

Compound Name3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide
PubChem CID67064544
Molecular FormulaC18H19N5O2
Molecular Weight337.38 g/mol
Exact Mass337.15
IUPAC Name3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide
SMILESCc1cccc(C(=O)Nc2cc(N3CCOCC3)n3nccc3n2)c1
InChIInChI=1S/C18H19N5O2/c1-13-3-2-4-14(11-13)18(24)21-15-12-17(22-7-9-25-10-8-22)23-16(20-15)5-6-19-23/h2-6,11-12H,7-10H2,1H3,(H,20,21,24)
InChIKeyMZULRRJWWYWGJJ-UHFFFAOYSA-N
XLogP2.13
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-morpholin-4-yl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide
CID 67064614
N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide
CID 67064569
N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-(5-oxo-4H-1,4-thiazin-3-yl)benzamide
CID 67064515
N-(4-amino-2-methyl-5-morpholin-4-ylphenyl)-3-methylbenzamide
CID 91676207
4-tert-butyl-N-[7-[(3-methylphenyl)methylamino]pyrazolo[1,5-a]pyrimidin-5-yl]benzamide
CID 67064340
3-methyl-N-(2-morpholin-4-yl-5-pyrrolidin-1-ylphenyl)benzamide
CID 110400455
methyl 4-[2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)acetyl]benzoate
CID 58207276
3-methyl-N-(6-methyl-2-pyridinyl)benzamide
CID 966005
N-(3-methylphenyl)-2-morpholin-4-ylpyrimidine-5-carboxamide
CID 20959447
5-[(3-methylbenzoyl)amino]-2-morpholin-4-ylbenzoic acid;2,2,2-trifluoroacetic acid
CID 146060806
N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-[(3-oxo-4H-1,4-benzoxazin-8-yl)methyl]piperidine-3-carboxamide
CID 67064759
2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone
CID 58207077

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide?
The IUPAC name of 3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide (CID 67064544) is 3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide.
What is the SMILES notation for 3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide?
The canonical SMILES for 3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide is Cc1cccc(C(=O)Nc2cc(N3CCOCC3)n3nccc3n2)c1.
What is the InChIKey of 3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide?
The InChIKey is MZULRRJWWYWGJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2/c1-13-3-2-4-14(11-13)18(24)21-15-12-17(22-7-9-25-10-8-22)23-16(20-15)5-6-19-23/h2-6,11-12H,7-10H2,1H3,(H,20,21,24).
What are the key properties of 3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide?
3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide has a molecular weight of 337.38 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide is sourced from PubChem (CID 67064544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).