N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine

C15H22N4 — CID 103932305

IUPACN-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine
SMILESCCn1nc(C)c(C(C)Nc2cncc(C)c2)c1C
InChIInChI=1S/C15H22N4/c1-6-19-13(5)15(12(4)18-19)11(3)17-14-7-10(2)8-16-9-14/h7-9,11,17H,6H2,1-5H3
InChIKeyULOLFVVWWOZBNF-UHFFFAOYSA-N
MW258.37 g/mol
LogP3.40
Rot. Bonds4

About N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine

N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine (PubChem CID 103932305) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine.

Molecular Properties

Compound NameN-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine
PubChem CID103932305
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC NameN-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine
SMILESCCn1nc(C)c(C(C)Nc2cncc(C)c2)c1C
InChIInChI=1S/C15H22N4/c1-6-19-13(5)15(12(4)18-19)11(3)17-14-7-10(2)8-16-9-14/h7-9,11,17H,6H2,1-5H3
InChIKeyULOLFVVWWOZBNF-UHFFFAOYSA-N
XLogP3.40
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine?
The IUPAC name of N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine (CID 103932305) is N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine.
What is the SMILES notation for N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine?
The canonical SMILES for N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine is CCn1nc(C)c(C(C)Nc2cncc(C)c2)c1C.
What is the InChIKey of N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine?
The InChIKey is ULOLFVVWWOZBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-6-19-13(5)15(12(4)18-19)11(3)17-14-7-10(2)8-16-9-14/h7-9,11,17H,6H2,1-5H3.
What are the key properties of N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine?
N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine has a molecular weight of 258.37 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyridin-3-amine is sourced from PubChem (CID 103932305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).