N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine

C10H11N3O — CID 79496321

IUPACN-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine
SMILESc1cncc(CNCc2ccon2)c1
InChIInChI=1S/C10H11N3O/c1-2-9(6-11-4-1)7-12-8-10-3-5-14-13-10/h1-6,12H,7-8H2
InChIKeyWUQDZUBBRQFEPJ-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.36
Rot. Bonds4

About N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine

N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine (PubChem CID 79496321) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine.

Molecular Properties

Compound NameN-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine
PubChem CID79496321
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC NameN-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine
SMILESc1cncc(CNCc2ccon2)c1
InChIInChI=1S/C10H11N3O/c1-2-9(6-11-4-1)7-12-8-10-3-5-14-13-10/h1-6,12H,7-8H2
InChIKeyWUQDZUBBRQFEPJ-UHFFFAOYSA-N
XLogP1.36
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-bromophenyl)-N-(1,2-oxazol-3-ylmethyl)methanamine
CID 79496120
1-pyridin-3-yl-N-(pyrimidin-4-ylmethyl)methanamine
CID 62760396
1-pyridin-4-yl-N-(pyridin-3-ylmethyl)methanamine;dihydrochloride
CID 163329891
N-[(3,5-dichlorophenyl)methyl]-1-pyridin-3-ylmethanamine
CID 54803200
1-(furan-3-yl)-N-(1,2-oxazol-3-ylmethyl)methanamine
CID 79493496
N-[(2,6-dichlorophenyl)methyl]-1-pyridin-3-ylmethanamine chloride
CID 21233303
1-phenyl-N-(pyridin-3-ylmethyl)methanamine;N-(pyridin-3-ylmethyl)ethanamine
CID 174270590
N-(pyridin-3-ylmethyl)propan-1-amine;yttrium
CID 59057937
N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine
CID 19626584
N-(pyridin-3-ylmethyl)prop-2-en-1-amine
CID 4717881
N-[(4-bromothiophen-2-yl)methyl]-1-pyridin-3-ylmethanamine
CID 28833084
1-pyridin-3-yl-N-(thiophen-3-ylmethyl)methanamine;dihydrochloride
CID 163328741

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine?
The IUPAC name of N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine (CID 79496321) is N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine.
What is the SMILES notation for N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine?
The canonical SMILES for N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine is c1cncc(CNCc2ccon2)c1.
What is the InChIKey of N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine?
The InChIKey is WUQDZUBBRQFEPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-2-9(6-11-4-1)7-12-8-10-3-5-14-13-10/h1-6,12H,7-8H2.
What are the key properties of N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine?
N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine has a molecular weight of 189.22 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-3-ylmethyl)-1-pyridin-3-ylmethanamine is sourced from PubChem (CID 79496321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).