N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide

C11H14N4O2S — CID 81118505

IUPACN-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide
SMILESCOc1csc(C(=O)NCc2cnn(C)c2N)c1
InChIInChI=1S/C11H14N4O2S/c1-15-10(12)7(5-14-15)4-13-11(16)9-3-8(17-2)6-18-9/h3,5-6H,4,12H2,1-2H3,(H,13,16)
InChIKeyPYOZUSPNPLMPTF-UHFFFAOYSA-N
MW266.33 g/mol
LogP1.00
Rot. Bonds4

About N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide

N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide (PubChem CID 81118505) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide
PubChem CID81118505
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC NameN-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide
SMILESCOc1csc(C(=O)NCc2cnn(C)c2N)c1
InChIInChI=1S/C11H14N4O2S/c1-15-10(12)7(5-14-15)4-13-11(16)9-3-8(17-2)6-18-9/h3,5-6H,4,12H2,1-2H3,(H,13,16)
InChIKeyPYOZUSPNPLMPTF-UHFFFAOYSA-N
XLogP1.00
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-methoxy-N-[2-(thiophen-3-ylmethyl)pyrazol-3-yl]thiophene-2-carboxamide
CID 71982647
4-methoxy-N-[2-(1-methylpiperidin-4-yl)pyrazol-3-yl]thiophene-2-carboxamide
CID 75375953
5-bromo-4-methoxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]thiophene-2-carboxamide
CID 71908387
4-methoxy-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide
CID 71982665
N-[4-(3-amino-4-cyanopyrazol-1-yl)phenyl]-4-methoxythiophene-2-carboxamide
CID 75375958
4-methoxy-N-(1H-pyrazol-5-yl)thiophene-2-carboxamide
CID 79461717
4-methoxy-N-(1H-pyrazol-4-ylmethyl)thiophene-2-carboxamide
CID 79465561
4-methoxy-N-methyl-N-(1H-pyrazol-4-ylmethyl)thiophene-2-carboxamide
CID 79465659
N-[(5-amino-1-methylpyrazol-4-yl)methyl]thiophene-2-carboxamide
CID 79523401
N-(4-amino-1,3-dimethylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide
CID 81117489
N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide
CID 81117571
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-3-methoxythiophene-2-carboxamide
CID 81118613

Frequently Asked Questions

What is the IUPAC name of N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide?
The IUPAC name of N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide (CID 81118505) is N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide.
What is the SMILES notation for N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide?
The canonical SMILES for N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide is COc1csc(C(=O)NCc2cnn(C)c2N)c1.
What is the InChIKey of N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide?
The InChIKey is PYOZUSPNPLMPTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c1-15-10(12)7(5-14-15)4-13-11(16)9-3-8(17-2)6-18-9/h3,5-6H,4,12H2,1-2H3,(H,13,16).
What are the key properties of N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide?
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide has a molecular weight of 266.33 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-amino-1-methylpyrazol-4-yl)methyl]-4-methoxythiophene-2-carboxamide is sourced from PubChem (CID 81118505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).