2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine

C10H17N3O — CID 131047869

IUPAC2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine
SMILESCc1cc(NCC2CCOC2)n(C)n1
InChIInChI=1S/C10H17N3O/c1-8-5-10(13(2)12-8)11-6-9-3-4-14-7-9/h5,9,11H,3-4,6-7H2,1-2H3
InChIKeyNFIQKNPPEYUUEF-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.18
Rot. Bonds3

About 2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine

2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine (PubChem CID 131047869) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine.

Molecular Properties

Compound Name2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine
PubChem CID131047869
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine
SMILESCc1cc(NCC2CCOC2)n(C)n1
InChIInChI=1S/C10H17N3O/c1-8-5-10(13(2)12-8)11-6-9-3-4-14-7-9/h5,9,11H,3-4,6-7H2,1-2H3
InChIKeyNFIQKNPPEYUUEF-UHFFFAOYSA-N
XLogP1.18
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,5-dimethylpyrazol-3-yl)-3-(oxolan-3-ylmethyl)urea
CID 47198130
N-[(4-aminocyclohexyl)methyl]-2,5-dimethylpyrazol-3-amine
CID 103568966
1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine
CID 115899682
2-methyl-N-(oxolan-3-ylmethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 113446299
1-methyl-N-(oxolan-3-ylmethyl)imidazol-2-amine
CID 62133287
2,5-dimethyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine
CID 103568968
N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-2,5-dimethylpyrazol-3-amine
CID 103569096
6-N-methyl-4-N-(oxolan-3-ylmethyl)-2-propylpyrimidine-4,6-diamine
CID 80955245
6-chloro-5-methyl-N-(oxolan-3-ylmethyl)pyrimidin-4-amine
CID 63728364
2,4-dimethyl-N-(oxolan-3-ylmethyl)aniline
CID 43189804
6-chloro-N-(oxolan-3-ylmethyl)-2-propylpyrimidin-4-amine
CID 80938193
5-methyl-2-N-(oxolan-3-ylmethyl)pyridine-2,4-diamine
CID 83265537

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine?
The IUPAC name of 2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine (CID 131047869) is 2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine.
What is the SMILES notation for 2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine?
The canonical SMILES for 2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine is Cc1cc(NCC2CCOC2)n(C)n1.
What is the InChIKey of 2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine?
The InChIKey is NFIQKNPPEYUUEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-8-5-10(13(2)12-8)11-6-9-3-4-14-7-9/h5,9,11H,3-4,6-7H2,1-2H3.
What are the key properties of 2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine?
2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine has a molecular weight of 195.27 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine is sourced from PubChem (CID 131047869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).