N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine

C14H14FN5O — CID 141279432

IUPACN-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine
SMILESCc1onc(-c2ccc(F)cn2)c1CNc1ccn(C)n1
InChIInChI=1S/C14H14FN5O/c1-9-11(8-17-13-5-6-20(2)18-13)14(19-21-9)12-4-3-10(15)7-16-12/h3-7H,8H2,1-2H3,(H,17,18)
InChIKeyCGVAVZOCSYYTHJ-UHFFFAOYSA-N
MW287.30 g/mol
LogP2.53
Rot. Bonds4

About N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine

N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine (PubChem CID 141279432) has the molecular formula C14H14FN5O and a molecular weight of 287.30 g/mol. Its IUPAC name is N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine.

Molecular Properties

Compound NameN-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine
PubChem CID141279432
Molecular FormulaC14H14FN5O
Molecular Weight287.30 g/mol
Exact Mass287.12
IUPAC NameN-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine
SMILESCc1onc(-c2ccc(F)cn2)c1CNc1ccn(C)n1
InChIInChI=1S/C14H14FN5O/c1-9-11(8-17-13-5-6-20(2)18-13)14(19-21-9)12-4-3-10(15)7-16-12/h3-7H,8H2,1-2H3,(H,17,18)
InChIKeyCGVAVZOCSYYTHJ-UHFFFAOYSA-N
XLogP2.53
TPSA68.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.30
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine with MolForge

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Related Compounds

2-[1-[(2-fluorophenyl)methyl]-5-(3-isoxazolyl)-1H-pyrazol-3-yl]-4-pyrimidinamine
CID 68642339
5-Fluoro-2-[1-[(2-fluorophenyl)methyl]-5-(1,2-oxazol-3-yl)pyrazol-3-yl]pyrimidin-4-amine
CID 68643387
3-[1-[(2-Fluorophenyl)methyl]-3-(5-fluoro-4-piperazin-1-ylpyrimidin-2-yl)pyrazol-5-yl]-1,2-oxazole
CID 86267519
5-fluoro-2-[1-[(2-fluorophenyl)methyl]-5-(1,2-oxazol-3-yl)pyrazol-3-yl]-N-methylpyrimidin-4-amine
CID 90446443
N-(6-fluoro-1H-pyrazolo[4,3-b]pyridin-3-yl)-3-methyl-1,2-benzoxazol-5-amine
CID 134190222
7-fluoro-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-5-amine
CID 134190227
US11472802, Example 11
CID 139341986
N-[1-(4-methylbenzyl)-1H-pyrazol-3-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[d]isoxazole-3-carboxamide
CID 3242754
5-(4-fluorophenyl)-N-[1-(4-methylbenzyl)-1H-pyrazol-3-yl]isoxazole-3-carboxamide
CID 3244953
N'-[3-(3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidin-5-yl]ethane-1,2-diamine
CID 72546472
2-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-4-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine
CID 11603221
4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-[[3-(5-fluoro-2-pyridinyl)-1,2-oxazol-5-yl]methyl]-6-methylpyrimidine-2,4-diamine
CID 59757902

Frequently Asked Questions

What is the IUPAC name of N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine?
The IUPAC name of N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine (CID 141279432) is N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine.
What is the SMILES notation for N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine?
The canonical SMILES for N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine is Cc1onc(-c2ccc(F)cn2)c1CNc1ccn(C)n1.
What is the InChIKey of N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine?
The InChIKey is CGVAVZOCSYYTHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN5O/c1-9-11(8-17-13-5-6-20(2)18-13)14(19-21-9)12-4-3-10(15)7-16-12/h3-7H,8H2,1-2H3,(H,17,18).
What are the key properties of N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine?
N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine has a molecular weight of 287.30 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methyl]-1-methylpyrazol-3-amine is sourced from PubChem (CID 141279432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).