6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine

C14H15N5O — CID 82555763

IUPAC6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine
SMILESCOc1ccc(CNc2ccc3nc(N)nn3c2)cc1
InChIInChI=1S/C14H15N5O/c1-20-12-5-2-10(3-6-12)8-16-11-4-7-13-17-14(15)18-19(13)9-11/h2-7,9,16H,8H2,1H3,(H2,15,18)
InChIKeyJYFWOFDRMXOPDC-UHFFFAOYSA-N
MW269.31 g/mol
LogP1.93
Rot. Bonds4

About 6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine

6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine (PubChem CID 82555763) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is 6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine
PubChem CID82555763
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC Name6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine
SMILESCOc1ccc(CNc2ccc3nc(N)nn3c2)cc1
InChIInChI=1S/C14H15N5O/c1-20-12-5-2-10(3-6-12)8-16-11-4-7-13-17-14(15)18-19(13)9-11/h2-7,9,16H,8H2,1H3,(H2,15,18)
InChIKeyJYFWOFDRMXOPDC-UHFFFAOYSA-N
XLogP1.93
TPSA77.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;hydrochloride
CID 177187059
4-methoxy-N-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]aniline
CID 62403164
6-N-[(4-methoxyphenyl)methyl]quinazoline-2,4,6-triamine
CID 44533101
3-N-(4-methoxyphenyl)-6-N-[(4-methoxyphenyl)methyl]pyridazine-3,6-diamine
CID 101161568
4-[(4-methoxyanilino)methyl]-N,N-dimethylaniline
CID 855075
N-[(4-methoxyphenyl)methyl]-3,4-dimethylaniline
CID 775241
N-[(4-cyclopropylphenyl)methyl]-4-methoxyaniline
CID 79979621
4-(2-methoxyethoxy)-N-[(4-methoxyphenyl)methyl]aniline
CID 43734131
4-(4-chlorophenoxy)-N-[(4-methoxyphenyl)methyl]aniline
CID 142720853
3,5-dichloro-N-[(4-methoxyphenyl)methyl]aniline
CID 23994439
4-N-[(4-methoxyphenyl)methyl]-6-(trifluoromethyl)pyridine-2,4-diamine
CID 177043715
N-[(4-methoxyphenyl)methyl]-4-(2-phenoxyethoxy)aniline
CID 54799583

Frequently Asked Questions

What is the IUPAC name of 6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
The IUPAC name of 6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine (CID 82555763) is 6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine.
What is the SMILES notation for 6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
The canonical SMILES for 6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine is COc1ccc(CNc2ccc3nc(N)nn3c2)cc1.
What is the InChIKey of 6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
The InChIKey is JYFWOFDRMXOPDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O/c1-20-12-5-2-10(3-6-12)8-16-11-4-7-13-17-14(15)18-19(13)9-11/h2-7,9,16H,8H2,1H3,(H2,15,18).
What are the key properties of 6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine has a molecular weight of 269.31 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[(4-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine is sourced from PubChem (CID 82555763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).