N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

C14H21N5 — CID 53017035

IUPACN-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1c(C)nc2ncnn2c1NC1CCCCC1
InChIInChI=1S/C14H21N5/c1-3-12-10(2)17-14-15-9-16-19(14)13(12)18-11-7-5-4-6-8-11/h9,11,18H,3-8H2,1-2H3
InChIKeyQVTUOTDBJOSMPU-UHFFFAOYSA-N
MW259.36 g/mol
LogP2.74
Rot. Bonds3

About N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine (PubChem CID 53017035) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound NameN-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
PubChem CID53017035
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC NameN-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1c(C)nc2ncnn2c1NC1CCCCC1
InChIInChI=1S/C14H21N5/c1-3-12-10(2)17-14-15-9-16-19(14)13(12)18-11-7-5-4-6-8-11/h9,11,18H,3-8H2,1-2H3
InChIKeyQVTUOTDBJOSMPU-UHFFFAOYSA-N
XLogP2.74
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,5-difluorophenyl)-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 53017028
5-ethyl-6-methyl-N-[4-(trifluoromethyl)cyclohexyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 143823904
N-cyclohexyl-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide
CID 20863538
5-chloro-N,6-dicyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 87798377
1-(6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidine-4-carboxylic acid
CID 175654822
6-chloro-5-ethyl-N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)cyclohexyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 58128403
N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 53259071
5-methyl-N-phenyl-6-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 22433942
3-[(5-chloro-6-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]cyclobutan-1-ol
CID 103076746
1-[4-[2-chloro-4-[(6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]phenyl]piperazin-1-yl]-2-methylpropan-1-one
CID 22433808
5-chloro-N-cyclohex-3-en-1-yl-6-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 114156779
6-benzyl-5-methyl-N-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 6501344

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine (CID 53017035) is N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine is CCc1c(C)nc2ncnn2c1NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is QVTUOTDBJOSMPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-3-12-10(2)17-14-15-9-16-19(14)13(12)18-11-7-5-4-6-8-11/h9,11,18H,3-8H2,1-2H3.
What are the key properties of N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 259.36 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-ethyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 53017035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).