5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

C11H16N6O — CID 14097492

IUPAC5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
SMILESCc1nc2ncnn2c(N)c1CN1CCOCC1
InChIInChI=1S/C11H16N6O/c1-8-9(6-16-2-4-18-5-3-16)10(12)17-11(15-8)13-7-14-17/h7H,2-6,12H2,1H3
InChIKeyUMFMGZMTPUMXCD-UHFFFAOYSA-N
MW248.29 g/mol
LogP-0.15
Rot. Bonds2

About 5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine (PubChem CID 14097492) has the molecular formula C11H16N6O and a molecular weight of 248.29 g/mol. Its IUPAC name is 5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
PubChem CID14097492
Molecular FormulaC11H16N6O
Molecular Weight248.29 g/mol
Exact Mass248.14
IUPAC Name5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
SMILESCc1nc2ncnn2c(N)c1CN1CCOCC1
InChIInChI=1S/C11H16N6O/c1-8-9(6-16-2-4-18-5-3-16)10(12)17-11(15-8)13-7-14-17/h7H,2-6,12H2,1H3
InChIKeyUMFMGZMTPUMXCD-UHFFFAOYSA-N
XLogP-0.15
TPSA81.57 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

(5,6-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-prop-2-ynyl-amine
CID 653352
4-[3-(7-Methyl-1,3,8,10,12-pentazatricyclo[7.3.0.02,6]dodeca-2(6),7,9,11-tetraen-3-yl)propyl]morpholine
CID 12666104
4-[2-(7-Methyl-1,3,8,10,12-pentazatricyclo[7.3.0.02,6]dodeca-2(6),7,9,11-tetraen-3-yl)ethyl]morpholine
CID 12671250
N-{[1-(2-methoxyethyl)-3-pyrrolidinyl]methyl}-N,1,3-trimethyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 56912322
1-[(1,3-Dimethylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-3-piperidin-1-ylpropan-2-ol
CID 70710071
1,3,6-trimethyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]pyrazolo[3,4-d]pyrimidin-4-amine
CID 70722674
(3S)-3-methyl-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 32810016
4-{5,6-Dimethyl-[1,2,4]triazolo[1,5-A]pyrimidin-7-YL}morpholine
CID 53017021
2,2,6-Trimethyl-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 56820118
N-{[4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]methyl}-2,5,6-trimethylpyrimidin-4-amine
CID 72853847
Ethyl 2-[(5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-methylamino]acetate
CID 75391336
4-(5,6-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-(2-methylpropyl)piperazin-2-one
CID 91650220

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine (CID 14097492) is 5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine is Cc1nc2ncnn2c(N)c1CN1CCOCC1.
What is the InChIKey of 5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is UMFMGZMTPUMXCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6O/c1-8-9(6-16-2-4-18-5-3-16)10(12)17-11(15-8)13-7-14-17/h7H,2-6,12H2,1H3.
What are the key properties of 5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 248.29 g/mol, XLogP of -0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 14097492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).