N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine

C14H23N5 — CID 63198104

IUPACN-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine
SMILESCCNC(Cc1cc(C)nc2ncnn12)C(C)(C)C
InChIInChI=1S/C14H23N5/c1-6-15-12(14(3,4)5)8-11-7-10(2)18-13-16-9-17-19(11)13/h7,9,12,15H,6,8H2,1-5H3
InChIKeyOJZGHRHKWIETFY-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.00
Rot. Bonds4

About N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine

N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine (PubChem CID 63198104) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine.

Molecular Properties

Compound NameN-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine
PubChem CID63198104
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC NameN-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine
SMILESCCNC(Cc1cc(C)nc2ncnn12)C(C)(C)C
InChIInChI=1S/C14H23N5/c1-6-15-12(14(3,4)5)8-11-7-10(2)18-13-16-9-17-19(11)13/h7,9,12,15H,6,8H2,1-5H3
InChIKeyOJZGHRHKWIETFY-UHFFFAOYSA-N
XLogP2.00
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)propan-2-amine
CID 63196488
N-(3,3-dimethylbutan-2-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 115685845
1-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]pentan-3-ol
CID 115702113
5-methyl-N-(3,3,3-trifluoropropyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 63226890
N-ethyl-3,3-dimethyl-1-(5-methylpyrimidin-2-yl)butan-2-amine
CID 63205876
5-methyl-N-(5-methylhexyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 79003007
5-methyl-N-(4,4,4-trifluorobutyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 79040439
N-(2,2-diphenylethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 3228693
2-ethyl-2-[[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]methyl]butan-1-ol
CID 103844405
N-(5-chloropentyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 107320766
2-[methyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]propan-1-ol
CID 115765238
N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 33386676

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine?
The IUPAC name of N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine (CID 63198104) is N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine.
What is the SMILES notation for N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine?
The canonical SMILES for N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine is CCNC(Cc1cc(C)nc2ncnn12)C(C)(C)C.
What is the InChIKey of N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine?
The InChIKey is OJZGHRHKWIETFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-6-15-12(14(3,4)5)8-11-7-10(2)18-13-16-9-17-19(11)13/h7,9,12,15H,6,8H2,1-5H3.
What are the key properties of N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine?
N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine has a molecular weight of 261.37 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,3-dimethyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butan-2-amine is sourced from PubChem (CID 63198104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).