N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine

C12H15N3O2 — CID 114180523

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine
SMILESCCc1cnc(CNc2ccnc(OC)c2)o1
InChIInChI=1S/C12H15N3O2/c1-3-10-7-15-12(17-10)8-14-9-4-5-13-11(6-9)16-2/h4-7H,3,8H2,1-2H3,(H,13,14)
InChIKeyVNDOUBRMJGTMRB-UHFFFAOYSA-N
MW233.27 g/mol
LogP2.25
Rot. Bonds5

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine (PubChem CID 114180523) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine
PubChem CID114180523
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine
SMILESCCc1cnc(CNc2ccnc(OC)c2)o1
InChIInChI=1S/C12H15N3O2/c1-3-10-7-15-12(17-10)8-14-9-4-5-13-11(6-9)16-2/h4-7H,3,8H2,1-2H3,(H,13,14)
InChIKeyVNDOUBRMJGTMRB-UHFFFAOYSA-N
XLogP2.25
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 24686998
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CID 24982457
N-[2-[2-(dimethylamino)ethoxy]-4-pyridinyl]-2-methoxyacetamide
CID 71905909
3-Methoxy-N~1~-{2-[(1-methyltetrahydro-1H-pyrrol-3-YL)oxy]-3-pyridyl}propanamide
CID 91904237
N-Methyl-4-(pyridin-3-yloxy)pyrrolidine-2-carboxamide
CID 86820400
N1-(furan-2-ylmethyl)-N2-(pyridin-4-yl)oxalamide
CID 18588753
5-oxo-N-[3-(pyridin-3-yloxy)propyl]-L-prolinamide
CID 118790587
N-[2-fluoro-5-(pyrrolidin-2-ylmethoxy)-3-pyridinyl]acetamide
CID 23227066
N-[2-fluoro-5-[[(2R)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]acetamide
CID 54387208
N-[2-fluoro-5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]acetamide
CID 54387209
2-ethoxy-4-fluoro-N-(1,3-oxazol-5-ylmethyl)aniline
CID 65965477
N-(1,3-oxazol-5-ylmethyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
CID 65966983

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine (CID 114180523) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine is CCc1cnc(CNc2ccnc(OC)c2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine?
The InChIKey is VNDOUBRMJGTMRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-3-10-7-15-12(17-10)8-14-9-4-5-13-11(6-9)16-2/h4-7H,3,8H2,1-2H3,(H,13,14).
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine has a molecular weight of 233.27 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methoxypyridin-4-amine is sourced from PubChem (CID 114180523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).