3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine

C12H19N5 — CID 106758620

IUPAC3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine
SMILESCCC(CC)n1cc(N)c(-c2ccnn2C)n1
InChIInChI=1S/C12H19N5/c1-4-9(5-2)17-8-10(13)12(15-17)11-6-7-14-16(11)3/h6-9H,4-5,13H2,1-3H3
InChIKeyDJQRLOVKYLBNBQ-UHFFFAOYSA-N
MW233.32 g/mol
LogP2.23
Rot. Bonds4

About 3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine

3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine (PubChem CID 106758620) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is 3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine.

Molecular Properties

Compound Name3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine
PubChem CID106758620
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC Name3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine
SMILESCCC(CC)n1cc(N)c(-c2ccnn2C)n1
InChIInChI=1S/C12H19N5/c1-4-9(5-2)17-8-10(13)12(15-17)11-6-7-14-16(11)3/h6-9H,4-5,13H2,1-3H3
InChIKeyDJQRLOVKYLBNBQ-UHFFFAOYSA-N
XLogP2.23
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-pentan-3-yl-3-pyridin-3-ylpyrazol-4-amine
CID 83218420
1-pentan-3-yl-3-(1,3,5-trimethylpyrazol-4-yl)pyrazol-4-amine
CID 83217307
3-(2-methylpyrazol-3-yl)-1-phenylpyrazol-4-amine
CID 106758594
3-(1-benzofuran-2-yl)-1-pentan-3-ylpyrazol-4-amine
CID 83218503
1-pentan-3-yl-3-(4-propan-2-yloxyphenyl)pyrazol-4-amine
CID 83203363
3-methyl-1-pentan-3-ylpyrazol-4-amine
CID 79421536
1-benzyl-3-(2-methylpyrazol-3-yl)pyrazol-4-amine
CID 106758588
1-(4-methylphenyl)-3-(2-methylpyrazol-3-yl)pyrazol-4-amine
CID 106758581
1-(3,5-dimethylphenyl)-3-(2-methylpyrazol-3-yl)pyrazol-4-amine
CID 106758585
1-[(3-methylphenyl)methyl]-3-(2-methylpyrazol-3-yl)pyrazol-4-amine
CID 106758609
5-chloro-3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazole
CID 165474574
3-[2-(difluoromethoxy)phenyl]-1-pentan-3-ylpyrazol-4-amine
CID 83203364

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine?
The IUPAC name of 3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine (CID 106758620) is 3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine.
What is the SMILES notation for 3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine?
The canonical SMILES for 3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine is CCC(CC)n1cc(N)c(-c2ccnn2C)n1.
What is the InChIKey of 3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine?
The InChIKey is DJQRLOVKYLBNBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c1-4-9(5-2)17-8-10(13)12(15-17)11-6-7-14-16(11)3/h6-9H,4-5,13H2,1-3H3.
What are the key properties of 3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine?
3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine has a molecular weight of 233.32 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpyrazol-3-yl)-1-pentan-3-ylpyrazol-4-amine is sourced from PubChem (CID 106758620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).