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

C10H12N4O2S — CID 81117571

IUPACN-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide
SMILESCOc1csc(C(=O)Nc2c(N)cnn2C)c1
InChIInChI=1S/C10H12N4O2S/c1-14-9(7(11)4-12-14)13-10(15)8-3-6(16-2)5-17-8/h3-5H,11H2,1-2H3,(H,13,15)
InChIKeySKRXKJQHQZTSQI-UHFFFAOYSA-N
MW252.30 g/mol
LogP1.32
Rot. Bonds3

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

N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide (PubChem CID 81117571) has the molecular formula C10H12N4O2S and a molecular weight of 252.30 g/mol. Its IUPAC name is N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide.

Molecular Properties

Compound NameN-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide
PubChem CID81117571
Molecular FormulaC10H12N4O2S
Molecular Weight252.30 g/mol
Exact Mass252.07
IUPAC NameN-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide
SMILESCOc1csc(C(=O)Nc2c(N)cnn2C)c1
InChIInChI=1S/C10H12N4O2S/c1-14-9(7(11)4-12-14)13-10(15)8-3-6(16-2)5-17-8/h3-5H,11H2,1-2H3,(H,13,15)
InChIKeySKRXKJQHQZTSQI-UHFFFAOYSA-N
XLogP1.32
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.30
LogP ≤ 51.32
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
3-(difluoromethoxy)-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]thiophene-2-carboxamide
CID 60259015
3-(difluoromethoxy)-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-5-methylthiophene-2-carboxamide
CID 60315732
4-methoxy-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]thiophene-2-carboxamide
CID 161037055
(E)-3-(furan-2-yl)-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]prop-2-enamide
CID 8911594
3-methoxy-N-[2-(oxolan-3-ylmethyl)pyrazol-3-yl]thiophene-2-carboxamide
CID 71878539
3-methoxy-5-methyl-N-(1-propylpyrazol-4-yl)thiophene-2-carboxamide
CID 71994321
3-(furan-2-yl)-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]prop-2-enamide
CID 72160557
5-bromo-4-methoxy-N-methyl-N-(2-methylpyrazol-3-yl)thiophene-2-carboxamide
CID 75391829
4-methoxy-N-(1H-pyrazol-5-yl)thiophene-2-carboxamide
CID 79461717
4-methoxy-N-(1H-pyrazol-4-yl)thiophene-2-carboxamide
CID 79466207

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide?
The IUPAC name of N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide (CID 81117571) is N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide.
What is the SMILES notation for N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide?
The canonical SMILES for N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide is COc1csc(C(=O)Nc2c(N)cnn2C)c1.
What is the InChIKey of N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide?
The InChIKey is SKRXKJQHQZTSQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2S/c1-14-9(7(11)4-12-14)13-10(15)8-3-6(16-2)5-17-8/h3-5H,11H2,1-2H3,(H,13,15).
What are the key properties of N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide?
N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide has a molecular weight of 252.30 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-1-methylpyrazol-5-yl)-4-methoxythiophene-2-carboxamide is sourced from PubChem (CID 81117571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).