N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine

C10H13N5O — CID 114600370

IUPACN-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine
SMILESCCn1cc(Nc2ncc(OC)cn2)cn1
InChIInChI=1S/C10H13N5O/c1-3-15-7-8(4-13-15)14-10-11-5-9(16-2)6-12-10/h4-7H,3H2,1-2H3,(H,11,12,14)
InChIKeyBXSMAGSIYHRXOD-UHFFFAOYSA-N
MW219.25 g/mol
LogP1.45
Rot. Bonds4

About N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine

N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine (PubChem CID 114600370) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine.

Molecular Properties

Compound NameN-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine
PubChem CID114600370
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC NameN-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine
SMILESCCn1cc(Nc2ncc(OC)cn2)cn1
InChIInChI=1S/C10H13N5O/c1-3-15-7-8(4-13-15)14-10-11-5-9(16-2)6-12-10/h4-7H,3H2,1-2H3,(H,11,12,14)
InChIKeyBXSMAGSIYHRXOD-UHFFFAOYSA-N
XLogP1.45
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-[(5-Fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol
CID 141287446
N-[1-(2-fluoroethyl)-3-methoxypyrazol-4-yl]-5-iodopyrimidin-2-amine
CID 154640449
3-(4-Fluoropyrazol-1-yl)-6-methoxy-1,2,4-triazine
CID 169574943
2-(4-Fluoropyrazol-1-yl)-5-methoxypyrimidine
CID 169574962
5-fluoro-N-[1-(oxolan-3-yl)pyrazol-4-yl]pyrimidin-2-amine
CID 175989978
5-fluoro-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrimidin-2-amine
CID 113286041
5-fluoro-4-(4-methoxypyrazol-1-yl)-N-propylpyrimidin-2-amine
CID 114274021
4-Fluoro-5-methoxy-2-[(1h-pyrazol-1-yl)methyl]pyrimidine
CID 164660035
2-[4-[4-(4-Methoxypyrazol-1-yl)butyl]piperazin-1-yl]pyrimidine
CID 14726853
N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrimidin-2-amine
CID 61511840
N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methylpyrimidin-4-amine
CID 62784182
N-[2-(4-aminopyrazol-1-yl)ethyl]-4,5-dimethoxypyrimidin-2-amine
CID 68283564

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine?
The IUPAC name of N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine (CID 114600370) is N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine.
What is the SMILES notation for N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine?
The canonical SMILES for N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine is CCn1cc(Nc2ncc(OC)cn2)cn1.
What is the InChIKey of N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine?
The InChIKey is BXSMAGSIYHRXOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-3-15-7-8(4-13-15)14-10-11-5-9(16-2)6-12-10/h4-7H,3H2,1-2H3,(H,11,12,14).
What are the key properties of N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine?
N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine has a molecular weight of 219.25 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrazol-4-yl)-5-methoxypyrimidin-2-amine is sourced from PubChem (CID 114600370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).