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

C12H15N3O — CID 103275184

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine
SMILESCCc1cnc(CNCc2ccncc2)o1
InChIInChI=1S/C12H15N3O/c1-2-11-8-15-12(16-11)9-14-7-10-3-5-13-6-4-10/h3-6,8,14H,2,7,9H2,1H3
InChIKeySMOGHMKKNZCIFW-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.92
Rot. Bonds5

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

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine (PubChem CID 103275184) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine
PubChem CID103275184
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine
SMILESCCc1cnc(CNCc2ccncc2)o1
InChIInChI=1S/C12H15N3O/c1-2-11-8-15-12(16-11)9-14-7-10-3-5-13-6-4-10/h3-6,8,14H,2,7,9H2,1H3
InChIKeySMOGHMKKNZCIFW-UHFFFAOYSA-N
XLogP1.92
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(4-trimethylsilylphenyl)methanamine
CID 106371023
4-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]benzonitrile
CID 104969494
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(furan-3-yl)methanamine
CID 103275149
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(4-propoxyphenyl)methanamine
CID 103275364
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(4-pyrazol-1-ylphenyl)methanamine
CID 104889468
1-(3,4-difluorophenyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]methanamine
CID 103275334
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1H-pyrazol-5-yl)methanamine
CID 103275150
1-(3-ethoxyphenyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]methanamine
CID 103096722
1-(4-bromo-3-fluorophenyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]methanamine
CID 103275273
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]methanamine
CID 104889435
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1H-imidazol-5-yl)methanamine
CID 103275143
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butan-1-amine
CID 106369292

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine (CID 103275184) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine is CCc1cnc(CNCc2ccncc2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine?
The InChIKey is SMOGHMKKNZCIFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-2-11-8-15-12(16-11)9-14-7-10-3-5-13-6-4-10/h3-6,8,14H,2,7,9H2,1H3.
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine has a molecular weight of 217.27 g/mol, XLogP of 1.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-4-ylmethanamine is sourced from PubChem (CID 103275184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).