N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine

C12H16N2O2 — CID 103275329

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine
SMILESCCc1cnc(CNCc2occc2C)o1
InChIInChI=1S/C12H16N2O2/c1-3-10-6-14-12(16-10)8-13-7-11-9(2)4-5-15-11/h4-6,13H,3,7-8H2,1-2H3
InChIKeyLWMWOQYVPIGUJI-UHFFFAOYSA-N
MW220.27 g/mol
LogP2.43
Rot. Bonds5

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine (PubChem CID 103275329) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine
PubChem CID103275329
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine
SMILESCCc1cnc(CNCc2occc2C)o1
InChIInChI=1S/C12H16N2O2/c1-3-10-6-14-12(16-10)8-13-7-11-9(2)4-5-15-11/h4-6,13H,3,7-8H2,1-2H3
InChIKeyLWMWOQYVPIGUJI-UHFFFAOYSA-N
XLogP2.43
TPSA51.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-furylmethyl)-N'-(4-pyridinylmethyl)ethanediamide
CID 2301154
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-N-methylpyridine-4-carboxamide
CID 34737685
N-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-N-methyl-1-(5-methylfuran-2-yl)methanamine
CID 53529909
N-(furan-2-ylmethyl)-2-[(5-methyl-2-pyridinyl)oxy]acetamide
CID 72003360
5-Tert-butyl-2-[1-[4-(furan-2-ylmethyl)piperazin-1-yl]ethyl]-1,3-oxazole
CID 75376161
4-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-N-(furan-2-ylmethyl)-3-methylbenzamide
CID 75426688
N-(furan-2-ylmethyl)-3-methyl-4-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide
CID 84588253
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 43042083
N-(furan-2-ylmethyl)pyridine-4-carboxamide
CID 5161348
5-[(2-Furylmethyl)amino]-2-(1-methylvinyl)-1,3-oxazole-4-carbonitrile
CID 16445560
3-[5-(2,4-difluorophenyl)-1,3-oxazol-2-yl]-N-(furan-2-ylmethyl)propanamide
CID 18135419
3-[5-(2,6-difluorophenyl)-1,3-oxazol-2-yl]-N-(furan-2-ylmethyl)-N-methylpropanamide
CID 29417334

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine (CID 103275329) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine is CCc1cnc(CNCc2occc2C)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine?
The InChIKey is LWMWOQYVPIGUJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-3-10-6-14-12(16-10)8-13-7-11-9(2)4-5-15-11/h4-6,13H,3,7-8H2,1-2H3.
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-methylfuran-2-yl)methanamine has a molecular weight of 220.27 g/mol, XLogP of 2.43, 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-(3-methylfuran-2-yl)methanamine is sourced from PubChem (CID 103275329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).