N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

C16H24N6O — CID 95303544

IUPACN-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
SMILESCCCc1cc(NC[C@H]2CN(C3CC3)CCO2)n2ncnc2n1
InChIInChI=1S/C16H24N6O/c1-2-3-12-8-15(22-16(20-12)18-11-19-22)17-9-14-10-21(6-7-23-14)13-4-5-13/h8,11,13-14,17H,2-7,9-10H2,1H3/t14-/m0/s1
InChIKeyICRBXZRQJNKGOS-AWEZNQCLSA-N
MW316.41 g/mol
LogP1.35
Rot. Bonds6

About N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine (PubChem CID 95303544) has the molecular formula C16H24N6O and a molecular weight of 316.41 g/mol. Its IUPAC name is N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound NameN-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
PubChem CID95303544
Molecular FormulaC16H24N6O
Molecular Weight316.41 g/mol
Exact Mass316.20
IUPAC NameN-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
SMILESCCCc1cc(NC[C@H]2CN(C3CC3)CCO2)n2ncnc2n1
InChIInChI=1S/C16H24N6O/c1-2-3-12-8-15(22-16(20-12)18-11-19-22)17-9-14-10-21(6-7-23-14)13-4-5-13/h8,11,13-14,17H,2-7,9-10H2,1H3/t14-/m0/s1
InChIKeyICRBXZRQJNKGOS-AWEZNQCLSA-N
XLogP1.35
TPSA67.58 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine with MolForge

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Related Compounds

N-[(4-methylmorpholin-2-yl)methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 154736482
N-(1-cyclopropylethyl)-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 71937878
N-[(1-methylpyrazol-4-yl)methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 86808876
N-ethyl-5-octyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 141209103
N-[[(2R)-4-cyclopropylmorpholin-2-yl]methyl]-6,7-dimethylquinazolin-4-amine
CID 97309523
N-[1-(cyclopentylmethyl)piperidin-4-yl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 128953223
(2R)-2-[(4-methylpyrazol-1-yl)methyl]-4-(5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 95282609
1-[(2R)-4-cyclopropylmorpholin-2-yl]-N-[(2-ethyl-1,3-thiazol-4-yl)methyl]methanamine
CID 95321562
5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]-6-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 103076972
N-(1,4-diazabicyclo[2.2.2]octan-2-ylmethyl)-5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 133399685
N-(2-cyclopropylethyl)-5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 133324314
5-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 86772190

Frequently Asked Questions

What is the IUPAC name of N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine (CID 95303544) is N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine is CCCc1cc(NC[C@H]2CN(C3CC3)CCO2)n2ncnc2n1.
What is the InChIKey of N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is ICRBXZRQJNKGOS-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H24N6O/c1-2-3-12-8-15(22-16(20-12)18-11-19-22)17-9-14-10-21(6-7-23-14)13-4-5-13/h8,11,13-14,17H,2-7,9-10H2,1H3/t14-/m0/s1.
What are the key properties of N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 316.41 g/mol, XLogP of 1.35, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]-5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 95303544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).