4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide

C11H16N6O — CID 103004054

IUPAC4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide
SMILESCn1cc(N)c(C(=O)NCCc2ccnn2C)n1
InChIInChI=1S/C11H16N6O/c1-16-7-9(12)10(15-16)11(18)13-5-3-8-4-6-14-17(8)2/h4,6-7H,3,5,12H2,1-2H3,(H,13,18)
InChIKeyBMIQIWSDRGXTJM-UHFFFAOYSA-N
MW248.29 g/mol
LogP-0.29
Rot. Bonds4

About 4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide

4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide (PubChem CID 103004054) has the molecular formula C11H16N6O and a molecular weight of 248.29 g/mol. Its IUPAC name is 4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide
PubChem CID103004054
Molecular FormulaC11H16N6O
Molecular Weight248.29 g/mol
Exact Mass248.14
IUPAC Name4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide
SMILESCn1cc(N)c(C(=O)NCCc2ccnn2C)n1
InChIInChI=1S/C11H16N6O/c1-16-7-9(12)10(15-16)11(18)13-5-3-8-4-6-14-17(8)2/h4,6-7H,3,5,12H2,1-2H3,(H,13,18)
InChIKeyBMIQIWSDRGXTJM-UHFFFAOYSA-N
XLogP-0.29
TPSA90.76 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazole-3-carboxamide
CID 65353862
4-amino-1-methyl-N-(2-phenylethyl)pyrazole-3-carboxamide
CID 19620372
4-amino-1-methyl-N-(2-pyridin-3-ylethyl)pyrazole-3-carboxamide
CID 65355277
3-amino-4-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 103004037
3-amino-4-bromo-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 103004100
1-methyl-3-[2-(2-methylpyrazol-3-yl)ethyl]urea
CID 104693382
5-amino-2-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 103004068
2,5-dihydroxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 107723981
4-amino-N-but-3-ynyl-1-methylpyrazole-3-carboxamide
CID 65355592
4-amino-1-methyl-N-(3,3,3-trifluoropropyl)pyrazole-3-carboxamide
CID 65354392
4-amino-N-hexyl-1-methylpyrazole-3-carboxamide
CID 65354108
5-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]furan-2-carboxamide
CID 104693705

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide?
The IUPAC name of 4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide (CID 103004054) is 4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide is Cn1cc(N)c(C(=O)NCCc2ccnn2C)n1.
What is the InChIKey of 4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide?
The InChIKey is BMIQIWSDRGXTJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6O/c1-16-7-9(12)10(15-16)11(18)13-5-3-8-4-6-14-17(8)2/h4,6-7H,3,5,12H2,1-2H3,(H,13,18).
What are the key properties of 4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide?
4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide has a molecular weight of 248.29 g/mol, XLogP of -0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide is sourced from PubChem (CID 103004054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).