N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine

C15H15N5O — CID 146078866

IUPACN-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine
SMILESCN(c1nc2ccccc2o1)C1CN(c2cnccn2)C1
InChIInChI=1S/C15H15N5O/c1-19(15-18-12-4-2-3-5-13(12)21-15)11-9-20(10-11)14-8-16-6-7-17-14/h2-8,11H,9-10H2,1H3
InChIKeyMGZPSYJFTPWJMG-UHFFFAOYSA-N
MW281.32 g/mol
LogP1.94
Rot. Bonds3

About N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine

N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine (PubChem CID 146078866) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine.

Molecular Properties

Compound NameN-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine
PubChem CID146078866
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC NameN-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine
SMILESCN(c1nc2ccccc2o1)C1CN(c2cnccn2)C1
InChIInChI=1S/C15H15N5O/c1-19(15-18-12-4-2-3-5-13(12)21-15)11-9-20(10-11)14-8-16-6-7-17-14/h2-8,11H,9-10H2,1H3
InChIKeyMGZPSYJFTPWJMG-UHFFFAOYSA-N
XLogP1.94
TPSA58.29 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N-methyl-1,3-benzoxazol-2-amine
CID 126918884
N-methyl-N-(1-methylpiperidin-3-yl)-1,3-benzoxazol-2-amine
CID 69368653
N-methyl-6-methylsulfanyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzothiazol-2-amine
CID 146079972
tert-butyl 3-[1,3-benzoxazol-2-yl(methyl)amino]pyrrolidine-1-carboxylate
CID 71647127
3-(1,3-benzoxazol-2-yl)-1-(4-pyrazin-2-ylpiperazin-1-yl)prop-2-en-1-one
CID 126805749
N-iodo-N-methyl-1,3-benzoxazol-2-amine
CID 142874451
2-(3,5-dimethylpiperazin-1-yl)pyrazine
CID 62585562
N-cyclohexyl-N-ethyl-1,3-benzoxazol-2-amine
CID 52672975
3-methyl-7-pyrazin-2-yl-9-oxa-3,7-diazabicyclo[3.3.1]nonane
CID 44599674
N,2,6-trimethyl-N-(1-pyrazin-2-ylpiperidin-4-yl)pyridin-4-amine
CID 166304823
5-chloro-N-methyl-N-(1-pyrazin-2-ylpiperidin-4-yl)pyrimidin-2-amine
CID 155942328
N,N-diphenyl-1,3-benzoxazol-2-amine
CID 101462195

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine?
The IUPAC name of N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine (CID 146078866) is N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine.
What is the SMILES notation for N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine?
The canonical SMILES for N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine is CN(c1nc2ccccc2o1)C1CN(c2cnccn2)C1.
What is the InChIKey of N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine?
The InChIKey is MGZPSYJFTPWJMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-19(15-18-12-4-2-3-5-13(12)21-15)11-9-20(10-11)14-8-16-6-7-17-14/h2-8,11H,9-10H2,1H3.
What are the key properties of N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine?
N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine has a molecular weight of 281.32 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-pyrazin-2-ylazetidin-3-yl)-1,3-benzoxazol-2-amine is sourced from PubChem (CID 146078866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).