N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine

C14H18N6 — CID 43783842

IUPACN-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine
SMILESCc1nc2ccccn2c1CNC(C)c1nncn1C
InChIInChI=1S/C14H18N6/c1-10-12(20-7-5-4-6-13(20)17-10)8-15-11(2)14-18-16-9-19(14)3/h4-7,9,11,15H,8H2,1-3H3
InChIKeyCSDNUBKCURGMAF-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.62
Rot. Bonds4

About N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine

N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine (PubChem CID 43783842) has the molecular formula C14H18N6 and a molecular weight of 270.34 g/mol. Its IUPAC name is N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine.

Molecular Properties

Compound NameN-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine
PubChem CID43783842
Molecular FormulaC14H18N6
Molecular Weight270.34 g/mol
Exact Mass270.16
IUPAC NameN-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine
SMILESCc1nc2ccccn2c1CNC(C)c1nncn1C
InChIInChI=1S/C14H18N6/c1-10-12(20-7-5-4-6-13(20)17-10)8-15-11(2)14-18-16-9-19(14)3/h4-7,9,11,15H,8H2,1-3H3
InChIKeyCSDNUBKCURGMAF-UHFFFAOYSA-N
XLogP1.62
TPSA60.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine?
The IUPAC name of N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine (CID 43783842) is N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine.
What is the SMILES notation for N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine?
The canonical SMILES for N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine is Cc1nc2ccccn2c1CNC(C)c1nncn1C.
What is the InChIKey of N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine?
The InChIKey is CSDNUBKCURGMAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6/c1-10-12(20-7-5-4-6-13(20)17-10)8-15-11(2)14-18-16-9-19(14)3/h4-7,9,11,15H,8H2,1-3H3.
What are the key properties of N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine?
N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine has a molecular weight of 270.34 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine is sourced from PubChem (CID 43783842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).