1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine

C10H15N5O — CID 106387646

IUPAC1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine
SMILESCc1cnc(C(C)Nc2nn(C)cc2N)o1
InChIInChI=1S/C10H15N5O/c1-6-4-12-10(16-6)7(2)13-9-8(11)5-15(3)14-9/h4-5,7H,11H2,1-3H3,(H,13,14)
InChIKeyKUVKNLSKYCBHBV-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.47
Rot. Bonds3

About 1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine

1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine (PubChem CID 106387646) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is 1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine.

Molecular Properties

Compound Name1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine
PubChem CID106387646
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC Name1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine
SMILESCc1cnc(C(C)Nc2nn(C)cc2N)o1
InChIInChI=1S/C10H15N5O/c1-6-4-12-10(16-6)7(2)13-9-8(11)5-15(3)14-9/h4-5,7H,11H2,1-3H3,(H,13,14)
InChIKeyKUVKNLSKYCBHBV-UHFFFAOYSA-N
XLogP1.47
TPSA81.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-1-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3-carboxamide
CID 114182277
3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazin-2-amine
CID 106388768
2-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzene-1,2-diamine
CID 106387648
3-chloro-2-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-2,5-diamine
CID 114182292
8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 106390408
5-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-2,5-diamine
CID 106387732
5-methyl-4-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propylpyrimidine-4,6-diamine
CID 106390334
1-methyl-5-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-3-propylpyrazole-4,5-diamine
CID 106387614
1-ethyl-3-methyl-5-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-4,5-diamine
CID 114182304
4-bromo-1-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzene-1,2-diamine
CID 106387609
6-hydrazinyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine
CID 106390425
4-chloro-2-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzene-1,2-diamine
CID 114182279

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine?
The IUPAC name of 1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine (CID 106387646) is 1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine.
What is the SMILES notation for 1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine?
The canonical SMILES for 1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine is Cc1cnc(C(C)Nc2nn(C)cc2N)o1.
What is the InChIKey of 1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine?
The InChIKey is KUVKNLSKYCBHBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c1-6-4-12-10(16-6)7(2)13-9-8(11)5-15(3)14-9/h4-5,7H,11H2,1-3H3,(H,13,14).
What are the key properties of 1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine?
1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine has a molecular weight of 221.26 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrazole-3,4-diamine is sourced from PubChem (CID 106387646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).