N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine

C14H17N5O — CID 103275232

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine
SMILESCCc1cnc(CNCc2cnc3cc(C)nn3c2)o1
InChIInChI=1S/C14H17N5O/c1-3-12-7-17-14(20-12)8-15-5-11-6-16-13-4-10(2)18-19(13)9-11/h4,6-7,9,15H,3,5,8H2,1-2H3
InChIKeyRXLQAFZHJTXDSV-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.88
Rot. Bonds5

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine (PubChem CID 103275232) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine
PubChem CID103275232
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine
SMILESCCc1cnc(CNCc2cnc3cc(C)nn3c2)o1
InChIInChI=1S/C14H17N5O/c1-3-12-7-17-14(20-12)8-15-5-11-6-16-13-4-10(2)18-19(13)9-11/h4,6-7,9,15H,3,5,8H2,1-2H3
InChIKeyRXLQAFZHJTXDSV-UHFFFAOYSA-N
XLogP1.88
TPSA68.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine with MolForge

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Related Compounds

4-N-methyl-2-N-[3-methyl-1-[2-(5-methyl-1,3-oxazol-2-yl)propan-2-yl]pyrazol-4-yl]-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 72190594
N-[5-(2-methyl-1,3-oxazol-5-yl)-2-propan-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]acetamide
CID 162467481
4,5-dimethyl-N-[1-(1,3-oxazol-2-yl)ethyl]-6-[2-(1H-pyrazol-4-yl)ethylamino]pyrimidine-2-carboxamide
CID 164553026
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-5-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 71888228
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 103718677
N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-5-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 133342140
N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-5-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 133342141
2-N-methyl-2-N-[3-methyl-1-[2-(5-methyl-1,3-oxazol-2-yl)propan-2-yl]pyrazol-4-yl]-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 153952759
5-Methyl-2-[1-(2,6,7,12-tetrazatricyclo[7.5.0.03,7]tetradeca-1,3,5,8-tetraen-8-yl)azetidin-3-yl]-1,3-oxazole
CID 67458765
1-[5-(2-Methyl-1,3-oxazol-5-yl)-2-propan-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]propan-2-one
CID 159323255
4,8-Dimethyl-2-[[1-[(2-propan-2-yl-1,3-oxazol-5-yl)methyl]pyrazol-4-yl]methylamino]-5,7-dihydropteridin-6-one
CID 166645034
7-N-(1,3-oxazol-2-ylmethyl)-5-N-(piperidin-4-ylmethyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine-5,7-diamine
CID 169597082

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine (CID 103275232) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine is CCc1cnc(CNCc2cnc3cc(C)nn3c2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine?
The InChIKey is RXLQAFZHJTXDSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-3-12-7-17-14(20-12)8-15-5-11-6-16-13-4-10(2)18-19(13)9-11/h4,6-7,9,15H,3,5,8H2,1-2H3.
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine has a molecular weight of 271.32 g/mol, XLogP of 1.88, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methanamine is sourced from PubChem (CID 103275232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).