1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine

C10H17N3O — CID 130736530

IUPAC1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine
SMILESCc1c(NCC2(C)COC2)cnn1C
InChIInChI=1S/C10H17N3O/c1-8-9(4-12-13(8)3)11-5-10(2)6-14-7-10/h4,11H,5-7H2,1-3H3
InChIKeyYBLNAEGGGHXUPF-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.18
Rot. Bonds3

About 1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine

1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine (PubChem CID 130736530) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine.

Molecular Properties

Compound Name1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine
PubChem CID130736530
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine
SMILESCc1c(NCC2(C)COC2)cnn1C
InChIInChI=1S/C10H17N3O/c1-8-9(4-12-13(8)3)11-5-10(2)6-14-7-10/h4,11H,5-7H2,1-3H3
InChIKeyYBLNAEGGGHXUPF-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-methyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-3-amine
CID 130685382
1,5-dimethyl-N-(oxolan-3-ylmethyl)pyrazol-4-amine
CID 115899682
1-(2-methoxyethyl)-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine
CID 107235162
2,4,6-trimethyl-N-[(3-methyloxetan-3-yl)methyl]aniline
CID 107235336
1,5-dimethyl-N-(1,3-oxazol-4-ylmethyl)pyrazol-4-amine
CID 130690140
5-bromo-N-[(3-methyloxetan-3-yl)methyl]pyridin-3-amine
CID 130161188
4-bromo-2-methyl-5-[(1-methylcyclobutyl)methylamino]pyridazin-3-one
CID 103736991
1,5-dimethyl-N-[(3-methylthiophen-2-yl)methyl]pyrazol-4-amine
CID 19626771
5,6-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 162629207
N-[(3-methyloxetan-3-yl)methyl]-2-(pyrazol-1-ylmethyl)aniline
CID 107235050
2-chloro-N-[(3-methyloxetan-3-yl)methyl]pyridin-4-amine
CID 103756861
5-methyl-1-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine
CID 69281648

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine?
The IUPAC name of 1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine (CID 130736530) is 1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine.
What is the SMILES notation for 1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine?
The canonical SMILES for 1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine is Cc1c(NCC2(C)COC2)cnn1C.
What is the InChIKey of 1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine?
The InChIKey is YBLNAEGGGHXUPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-8-9(4-12-13(8)3)11-5-10(2)6-14-7-10/h4,11H,5-7H2,1-3H3.
What are the key properties of 1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine?
1,5-dimethyl-N-[(3-methyloxetan-3-yl)methyl]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-[(3-methyloxetan-3-yl)methyl]pyrazol-4-amine is sourced from PubChem (CID 130736530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).