1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine

C10H17N3O — CID 115899682

IUPAC1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine
SMILESCc1c(NCC2CCOC2)cnn1C
InChIInChI=1S/C10H17N3O/c1-8-10(6-12-13(8)2)11-5-9-3-4-14-7-9/h6,9,11H,3-5,7H2,1-2H3
InChIKeyHUHXWHKRMGOKGF-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.18
Rot. Bonds3

About 1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine

1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine (PubChem CID 115899682) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine.

Molecular Properties

Compound Name1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine
PubChem CID115899682
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine
SMILESCc1c(NCC2CCOC2)cnn1C
InChIInChI=1S/C10H17N3O/c1-8-10(6-12-13(8)2)11-5-9-3-4-14-7-9/h6,9,11H,3-5,7H2,1-2H3
InChIKeyHUHXWHKRMGOKGF-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

2,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-3-amine
CID 131047869
N-(1,5-dimethylpyrazol-4-yl)-2-(oxan-3-yl)acetamide
CID 134702628
N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-(oxan-3-yl)methanamine
CID 79579340
1,5-dimethyl-N-(oxan-3-yl)pyrazol-4-amine
CID 115923293
N-(oxolan-3-ylmethyl)-1-propylpyrazol-4-amine
CID 115887965
2,4-dimethyl-N-(oxolan-3-ylmethyl)aniline
CID 43189804
1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine
CID 130736530
1-methyl-N-(oxolan-3-ylmethyl)imidazol-2-amine
CID 62133287
3-bromo-N-(oxolan-3-ylmethyl)pyridin-4-amine
CID 104776871
N-[(2-methylpyrazol-3-yl)methyl]-1-(oxolan-3-yl)methanamine
CID 60920797
3-fluoro-N-(oxolan-3-ylmethyl)pyridin-4-amine
CID 130678795
4-chloro-2-(4-chlorophenyl)-5-[[(3S)-oxolan-3-yl]methylamino]pyridazin-3-one
CID 94415319

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine?
The IUPAC name of 1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine (CID 115899682) is 1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine.
What is the SMILES notation for 1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine?
The canonical SMILES for 1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine is Cc1c(NCC2CCOC2)cnn1C.
What is the InChIKey of 1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine?
The InChIKey is HUHXWHKRMGOKGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-8-10(6-12-13(8)2)11-5-9-3-4-14-7-9/h6,9,11H,3-5,7H2,1-2H3.
What are the key properties of 1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine?
1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-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 1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine is sourced from PubChem (CID 115899682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).