(7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine

C10H15N5 — CID 84673402

IUPAC(7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine
SMILESCC(C)(C)c1ccnc2nc(CN)nn12
InChIInChI=1S/C10H15N5/c1-10(2,3)7-4-5-12-9-13-8(6-11)14-15(7)9/h4-5H,6,11H2,1-3H3
InChIKeyFNDYQJCFIUPSQW-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.88
Rot. Bonds1

About (7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine

(7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine (PubChem CID 84673402) has the molecular formula C10H15N5 and a molecular weight of 205.26 g/mol. Its IUPAC name is (7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine.

Molecular Properties

Compound Name(7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine
PubChem CID84673402
Molecular FormulaC10H15N5
Molecular Weight205.26 g/mol
Exact Mass205.13
IUPAC Name(7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine
SMILESCC(C)(C)c1ccnc2nc(CN)nn12
InChIInChI=1S/C10H15N5/c1-10(2,3)7-4-5-12-9-13-8(6-11)14-15(7)9/h4-5H,6,11H2,1-3H3
InChIKeyFNDYQJCFIUPSQW-UHFFFAOYSA-N
XLogP0.88
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)methanamine
CID 103318377
(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine;dihydrochloride
CID 146050004
(2S)-1-[4-(7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)piperazin-1-yl]-2-chloropropan-1-one
CID 92758144
2-(aminomethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 13019084
2-(methoxymethyl)-7-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 47001682
methyl 2-(7-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetate
CID 103200956
N-[2-(aminomethyl)cyclohexyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide;dihydrochloride
CID 119612281
N-methoxy-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 47143299
methyl 2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl)amino]acetate
CID 43409090
N'-[7-[2-(4-chloro-2-methylphenoxy)propan-2-yl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-N-methoxymethanimidamide
CID 75240432
7-(5-bromothiophen-2-yl)-2-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 75465921
2-(methoxymethyl)-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 121239944

Frequently Asked Questions

What is the IUPAC name of (7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine?
The IUPAC name of (7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine (CID 84673402) is (7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine.
What is the SMILES notation for (7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine?
The canonical SMILES for (7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine is CC(C)(C)c1ccnc2nc(CN)nn12.
What is the InChIKey of (7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine?
The InChIKey is FNDYQJCFIUPSQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c1-10(2,3)7-4-5-12-9-13-8(6-11)14-15(7)9/h4-5H,6,11H2,1-3H3.
What are the key properties of (7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine?
(7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine has a molecular weight of 205.26 g/mol, XLogP of 0.88, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanamine is sourced from PubChem (CID 84673402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).