N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine

C10H14N4O — CID 62743049

IUPACN-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine
SMILESCc1cc(CNCc2nc[nH]c2C)no1
InChIInChI=1S/C10H14N4O/c1-7-3-9(14-15-7)4-11-5-10-8(2)12-6-13-10/h3,6,11H,4-5H2,1-2H3,(H,12,13)
InChIKeyIIJGOTOXOQBRCC-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.30
Rot. Bonds4

About N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine

N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine (PubChem CID 62743049) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine.

Molecular Properties

Compound NameN-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine
PubChem CID62743049
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC NameN-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine
SMILESCc1cc(CNCc2nc[nH]c2C)no1
InChIInChI=1S/C10H14N4O/c1-7-3-9(14-15-7)4-11-5-10-8(2)12-6-13-10/h3,6,11H,4-5H2,1-2H3,(H,12,13)
InChIKeyIIJGOTOXOQBRCC-UHFFFAOYSA-N
XLogP1.30
TPSA66.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1-(1H-pyrrol-2-yl)methanamine
CID 62340417
N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(3,4,5-trimethoxyphenyl)methanamine
CID 62749035
2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-1-amine
CID 60686114
4-[[(5-methyl-1,2-oxazol-3-yl)methylamino]methyl]pyrimidine-5-carboxylic acid
CID 103243699
(5-methyl-1,2-oxazol-3-yl)methylhydrazine
CID 66157923
N-[(1-methylindazol-3-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine
CID 63001057
3-fluoro-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-1-amine
CID 81106816
N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-(1,2,4-oxadiazol-3-yl)ethanamine
CID 106395888
N-[(1-methylcyclopentyl)methyl]-1-(5-methyl-1H-imidazol-4-yl)methanamine
CID 63822913
1-(6-methoxy-3-pyridinyl)-N-[(5-methyl-1H-imidazol-4-yl)methyl]methanamine
CID 62748169
N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 60702122
N-[(5-methyl-1,2-oxazol-3-yl)methyl]heptan-1-amine
CID 60691345

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine?
The IUPAC name of N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine (CID 62743049) is N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine.
What is the SMILES notation for N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine?
The canonical SMILES for N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine is Cc1cc(CNCc2nc[nH]c2C)no1.
What is the InChIKey of N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine?
The InChIKey is IIJGOTOXOQBRCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c1-7-3-9(14-15-7)4-11-5-10-8(2)12-6-13-10/h3,6,11H,4-5H2,1-2H3,(H,12,13).
What are the key properties of N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine?
N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine has a molecular weight of 206.25 g/mol, XLogP of 1.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanamine is sourced from PubChem (CID 62743049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).