2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine

C14H21N5 — CID 115530675

IUPAC2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine
SMILESCCn1nc(C)cc1CC(NC)c1ccnc(C)n1
InChIInChI=1S/C14H21N5/c1-5-19-12(8-10(2)18-19)9-14(15-4)13-6-7-16-11(3)17-13/h6-8,14-15H,5,9H2,1-4H3
InChIKeyYKUFOSMTDGMQTB-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.81
Rot. Bonds5

About 2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine

2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine (PubChem CID 115530675) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine.

Molecular Properties

Compound Name2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine
PubChem CID115530675
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine
SMILESCCn1nc(C)cc1CC(NC)c1ccnc(C)n1
InChIInChI=1S/C14H21N5/c1-5-19-12(8-10(2)18-19)9-14(15-4)13-6-7-16-11(3)17-13/h6-8,14-15H,5,9H2,1-4H3
InChIKeyYKUFOSMTDGMQTB-UHFFFAOYSA-N
XLogP1.81
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2,6-dimethyl-4-pyridinyl)-2-(2-ethyl-5-methylpyrazol-3-yl)-N-methylethanamine
CID 107503544
[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-methyl-2-pyridinyl)ethyl]hydrazine
CID 105219848
2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
CID 105162307
2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2,4,5-trimethylfuran-3-yl)ethanamine
CID 105002740
1-(2-bromo-5-methylphenyl)-2-(2-ethyl-5-methylpyrazol-3-yl)-N-methylethanamine
CID 105002601
2-(2-ethyl-5-methylpyrazol-3-yl)-1-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 105002673
1-(3-bromo-5-methylphenyl)-2-(2-ethyl-5-methylpyrazol-3-yl)-N-methylethanamine
CID 105002588
2-(2-ethyl-5-methylpyrazol-3-yl)-1-(3-methoxythiophen-2-yl)-N-methylethanamine
CID 105002642
3-ethyl-N-methyl-1-(2-methylpyrimidin-4-yl)pentan-1-amine
CID 82922386
1-(5-bromo-4-methylthiophen-2-yl)-2-(2-ethyl-5-methylpyrazol-3-yl)-N-methylethanamine
CID 105002532
[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(3-methyl-4-pyridinyl)ethyl]hydrazine
CID 105261743
1-(3-chloro-4-methylthiophen-2-yl)-2-(2-ethyl-5-methylpyrazol-3-yl)-N-methylethanamine
CID 103406541

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine?
The IUPAC name of 2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine (CID 115530675) is 2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine.
What is the SMILES notation for 2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine?
The canonical SMILES for 2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine is CCn1nc(C)cc1CC(NC)c1ccnc(C)n1.
What is the InChIKey of 2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine?
The InChIKey is YKUFOSMTDGMQTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-5-19-12(8-10(2)18-19)9-14(15-4)13-6-7-16-11(3)17-13/h6-8,14-15H,5,9H2,1-4H3.
What are the key properties of 2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine?
2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine has a molecular weight of 259.36 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-5-methylpyrazol-3-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)ethanamine is sourced from PubChem (CID 115530675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).