N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine

C14H13N3O — CID 142272205

IUPACN-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine
SMILESCNc1ccc(-c2nc3cccc(C)c3o2)cn1
InChIInChI=1S/C14H13N3O/c1-9-4-3-5-11-13(9)18-14(17-11)10-6-7-12(15-2)16-8-10/h3-8H,1-2H3,(H,15,16)
InChIKeyOSJRUOSOJPXRAF-UHFFFAOYSA-N
MW239.28 g/mol
LogP3.24
Rot. Bonds2

About N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine

N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine (PubChem CID 142272205) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine
PubChem CID142272205
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC NameN-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine
SMILESCNc1ccc(-c2nc3cccc(C)c3o2)cn1
InChIInChI=1S/C14H13N3O/c1-9-4-3-5-11-13(9)18-14(17-11)10-6-7-12(15-2)16-8-10/h3-8H,1-2H3,(H,15,16)
InChIKeyOSJRUOSOJPXRAF-UHFFFAOYSA-N
XLogP3.24
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine
CID 59679624
7-methyl-2-(4-phenylphenyl)-1,3-benzoxazole
CID 15259011
ethane;2-(4-methoxyphenyl)-7-methyl-1,3-benzoxazole
CID 145409461
2-(4-methylphenyl)-[1,3]oxazolo[4,5-c]quinoline
CID 4541188
2-(2-benzofuran-1-yl)-7-methyl-1,3-benzoxazole
CID 57321541
5-(7-methyl-1,3-benzoxazol-2-yl)-2-propan-2-ylphenol
CID 171512133
4-[2-[2-[4-(7-methyl-1,3-benzoxazol-2-yl)phenyl]phenyl]phenyl]-N,N-diphenylaniline
CID 59228382
2-[4-(5a-methyl-9aH-dibenzofuran-4-yl)phenyl]-7-methyl-1,3-benzoxazole
CID 163576719
2-(2-methylphenyl)-1,3-benzoxazol-7-ol
CID 84689691
2,7-bis(4-methylphenyl)-[1,3]benzoxazolo[7,6-g][1,3]benzoxazole
CID 118531011
5-[5-[2-[2-(2-(18F)fluoroethoxy)ethoxy]ethoxy]-1,3-benzoxazol-2-yl]-N-methylpyridin-2-amine
CID 71457286
5-[5-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]-1,3-benzoxazol-2-yl]-N-methylpyridin-2-amine
CID 71462647

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine?
The IUPAC name of N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine (CID 142272205) is N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine.
What is the SMILES notation for N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine?
The canonical SMILES for N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine is CNc1ccc(-c2nc3cccc(C)c3o2)cn1.
What is the InChIKey of N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine?
The InChIKey is OSJRUOSOJPXRAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-9-4-3-5-11-13(9)18-14(17-11)10-6-7-12(15-2)16-8-10/h3-8H,1-2H3,(H,15,16).
What are the key properties of N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine?
N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine has a molecular weight of 239.28 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(7-methyl-1,3-benzoxazol-2-yl)pyridin-2-amine is sourced from PubChem (CID 142272205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).