N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine

C12H16N4 — CID 115762824

IUPACN-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine
SMILESCCn1nccc1CNc1cccnc1C
InChIInChI=1S/C12H16N4/c1-3-16-11(6-8-15-16)9-14-12-5-4-7-13-10(12)2/h4-8,14H,3,9H2,1-2H3
InChIKeyBOTJNYZUKUJZPK-UHFFFAOYSA-N
MW216.29 g/mol
LogP2.22
Rot. Bonds4

About N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine

N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine (PubChem CID 115762824) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine.

Molecular Properties

Compound NameN-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine
PubChem CID115762824
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC NameN-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine
SMILESCCn1nccc1CNc1cccnc1C
InChIInChI=1S/C12H16N4/c1-3-16-11(6-8-15-16)9-14-12-5-4-7-13-10(12)2/h4-8,14H,3,9H2,1-2H3
InChIKeyBOTJNYZUKUJZPK-UHFFFAOYSA-N
XLogP2.22
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-N-[(2-ethylpyrazol-3-yl)methyl]pyridin-3-amine
CID 104819748
N-[(2-ethylpyrazol-3-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine
CID 75505630
3-chloro-N-[(2-ethylpyrazol-3-yl)methyl]-2-methylaniline
CID 115762690
N-[(2-ethylpyrazol-3-yl)methyl]-2-ethylsulfonylaniline
CID 114555359
N-[(2-ethylpyrazol-3-yl)methyl]-2-ethylsulfanylaniline
CID 115762792
2-ethoxy-N-[(2-ethylpyrazol-3-yl)methyl]-4-methylaniline
CID 115762789
N-[(2-ethylpyrazol-3-yl)methyl]-3-methyl-1-propylpyrazol-4-amine
CID 122166720
N-[(1-ethylimidazol-2-yl)methyl]-2-methylpyridin-3-amine
CID 79041847
4-bromo-N-[(2-ethylpyrazol-3-yl)methyl]naphthalen-1-amine
CID 114556070
N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-5-methylaniline
CID 19619277
N-[(2-ethylpyrazol-3-yl)methyl]-2-methyl-5-methylsulfonylaniline
CID 114555098
N-[(2-ethylpyrazol-3-yl)methyl]-4-methyl-2-propoxyaniline
CID 115762790

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine?
The IUPAC name of N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine (CID 115762824) is N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine.
What is the SMILES notation for N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine?
The canonical SMILES for N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine is CCn1nccc1CNc1cccnc1C.
What is the InChIKey of N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine?
The InChIKey is BOTJNYZUKUJZPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-3-16-11(6-8-15-16)9-14-12-5-4-7-13-10(12)2/h4-8,14H,3,9H2,1-2H3.
What are the key properties of N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine?
N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine has a molecular weight of 216.29 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethylpyrazol-3-yl)methyl]-2-methylpyridin-3-amine is sourced from PubChem (CID 115762824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).