N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine

C15H17N5 — CID 62971671

IUPACN-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESCc1cc(N(C)c2ccc(CN)cc2)n2ncnc2c1
InChIInChI=1S/C15H17N5/c1-11-7-14-17-10-18-20(14)15(8-11)19(2)13-5-3-12(9-16)4-6-13/h3-8,10H,9,16H2,1-2H3
InChIKeyRTRJAIYTBPMCOG-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.26
Rot. Bonds3

About N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine

N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine (PubChem CID 62971671) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
PubChem CID62971671
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC NameN-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESCc1cc(N(C)c2ccc(CN)cc2)n2ncnc2c1
InChIInChI=1S/C15H17N5/c1-11-7-14-17-10-18-20(14)15(8-11)19(2)13-5-3-12(9-16)4-6-13/h3-8,10H,9,16H2,1-2H3
InChIKeyRTRJAIYTBPMCOG-UHFFFAOYSA-N
XLogP2.26
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The IUPAC name of N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine (CID 62971671) is N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine is Cc1cc(N(C)c2ccc(CN)cc2)n2ncnc2c1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The InChIKey is RTRJAIYTBPMCOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-11-7-14-17-10-18-20(14)15(8-11)19(2)13-5-3-12(9-16)4-6-13/h3-8,10H,9,16H2,1-2H3.
What are the key properties of N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine has a molecular weight of 267.34 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine is sourced from PubChem (CID 62971671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).