N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine

C13H20N4 — CID 63202350

IUPACN-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine
SMILESCCNC(CC)Cc1cc(C)cc2ncnn12
InChIInChI=1S/C13H20N4/c1-4-11(14-5-2)8-12-6-10(3)7-13-15-9-16-17(12)13/h6-7,9,11,14H,4-5,8H2,1-3H3
InChIKeyISRSEVQLZUYUJG-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.97
Rot. Bonds5

About N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine

N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine (PubChem CID 63202350) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine
PubChem CID63202350
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC NameN-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine
SMILESCCNC(CC)Cc1cc(C)cc2ncnn12
InChIInChI=1S/C13H20N4/c1-4-11(14-5-2)8-12-6-10(3)7-13-15-9-16-17(12)13/h6-7,9,11,14H,4-5,8H2,1-3H3
InChIKeyISRSEVQLZUYUJG-UHFFFAOYSA-N
XLogP1.97
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-bromobutyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 63203897
1-methoxy-N-methyl-3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-amine
CID 55162388
1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-ol
CID 63201068
N-[1-cyclopropyl-2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)ethyl]propan-1-amine
CID 55202827
N-hexan-3-yl-7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 62046630
2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pentan-3-ol
CID 63559839
7-methyl-N-(2-pyrazol-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 54951187
N-(2-chloro-3-ethylpentyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 106286878
4-methyl-3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)-N-propylpentan-2-amine
CID 63197670
N-(3-chlorobutyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 65028368
N-(3,3-dimethylbutyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 113222610
N-butan-2-yl-3-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)amino]propanamide
CID 60966544

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine?
The IUPAC name of N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine (CID 63202350) is N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine.
What is the SMILES notation for N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine?
The canonical SMILES for N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine is CCNC(CC)Cc1cc(C)cc2ncnn12.
What is the InChIKey of N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine?
The InChIKey is ISRSEVQLZUYUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-4-11(14-5-2)8-12-6-10(3)7-13-15-9-16-17(12)13/h6-7,9,11,14H,4-5,8H2,1-3H3.
What are the key properties of N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine?
N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine has a molecular weight of 232.33 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)butan-2-amine is sourced from PubChem (CID 63202350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).