(5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine

C10H15N5O — CID 43559291

IUPAC(5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine
SMILESCc1nc(C(N)c2c(C)nn(C)c2C)no1
InChIInChI=1S/C10H15N5O/c1-5-8(6(2)15(4)13-5)9(11)10-12-7(3)16-14-10/h9H,11H2,1-4H3
InChIKeyHFXNXCJYPGBODT-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.78
Rot. Bonds2

About (5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine

(5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine (PubChem CID 43559291) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is (5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine.

Molecular Properties

Compound Name(5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine
PubChem CID43559291
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC Name(5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine
SMILESCc1nc(C(N)c2c(C)nn(C)c2C)no1
InChIInChI=1S/C10H15N5O/c1-5-8(6(2)15(4)13-5)9(11)10-12-7(3)16-14-10/h9H,11H2,1-4H3
InChIKeyHFXNXCJYPGBODT-UHFFFAOYSA-N
XLogP0.78
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-{[3-(3-methylbutyl)-1,2,4-oxadiazol-5-yl]methyl}-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]propan-2-amine
CID 16191178
2-(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)ethyl]acetamide
CID 56877804
5-Cyclopropyl-3-[[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]methyl]-1,2,4-oxadiazole
CID 72141636
2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 72149503
N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3,4,5-trimethyl-1H-pyrazol-1-yl)propanamide
CID 56865182
N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-3-methyl-1,2,4-oxadiazol-5-amine
CID 75498183
(1R)-2,2,2-trifluoro-N-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-1-(1,3,5-trimethylpyrazol-4-yl)ethanamine
CID 97098990
2-(4-{[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl](methyl)amino]methyl}-3,5-dimethyl-1H-pyrazol-1-yl)ethanol
CID 109931839
4-(3-isopropyl-1,2,4-oxadiazol-5-yl)-N-[2-(3,4,5-trimethyl-1H-pyrazol-1-yl)ethyl]piperidine-1-carboxamide
CID 124216938
1-[(5-Ethyl-1,2,4-oxadiazol-3-yl)methyl]-5-methyl-3-(trifluoromethyl)pyrazol-4-amine
CID 118171275
1-[(3-Ethyl-1,2,4-oxadiazol-5-yl)methyl]-5-methyl-3-(trifluoromethyl)pyrazol-4-amine
CID 124139767
[5-(Trifluoromethyl)-1,2,4-oxadiazol-3-yl]-(1,3,5-trimethylpyrazol-4-yl)methanamine
CID 43559996

Frequently Asked Questions

What is the IUPAC name of (5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine?
The IUPAC name of (5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine (CID 43559291) is (5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine.
What is the SMILES notation for (5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine?
The canonical SMILES for (5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine is Cc1nc(C(N)c2c(C)nn(C)c2C)no1.
What is the InChIKey of (5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine?
The InChIKey is HFXNXCJYPGBODT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c1-5-8(6(2)15(4)13-5)9(11)10-12-7(3)16-14-10/h9H,11H2,1-4H3.
What are the key properties of (5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine?
(5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine has a molecular weight of 221.26 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-1,2,4-oxadiazol-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine is sourced from PubChem (CID 43559291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).