4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide

C11H15N5O — CID 104616582

IUPAC4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide
SMILESCCc1cn[nH]c1NC(=O)c1cc(N)cn1C
InChIInChI=1S/C11H15N5O/c1-3-7-5-13-15-10(7)14-11(17)9-4-8(12)6-16(9)2/h4-6H,3,12H2,1-2H3,(H2,13,14,15,17)
InChIKeyKOGSCWVWUJQHJJ-UHFFFAOYSA-N
MW233.28 g/mol
LogP1.15
Rot. Bonds3

About 4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide

4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide (PubChem CID 104616582) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is 4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide
PubChem CID104616582
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC Name4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide
SMILESCCc1cn[nH]c1NC(=O)c1cc(N)cn1C
InChIInChI=1S/C11H15N5O/c1-3-7-5-13-15-10(7)14-11(17)9-4-8(12)6-16(9)2/h4-6H,3,12H2,1-2H3,(H2,13,14,15,17)
InChIKeyKOGSCWVWUJQHJJ-UHFFFAOYSA-N
XLogP1.15
TPSA88.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 51.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-propan-2-ylpyrrole-2-carboxamide
CID 104616606
4-amino-1-cyclopropyl-N-(4-ethyl-1H-pyrazol-5-yl)pyrrole-2-carboxamide
CID 104616599
4,5-dichloro-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide
CID 112697051
4-chloro-N-(4-ethyl-1H-pyrazol-5-yl)-1-propylpyrrole-2-carboxamide
CID 104620364
4-amino-N-(1-ethylpyrazol-4-yl)-1-methylpyrrole-2-carboxamide
CID 43643735
4-amino-1-methyl-N-pyrimidin-5-ylpyrrole-2-carboxamide
CID 107587408
N-(4-ethyl-1H-pyrazol-5-yl)-1,5-dimethylpyrazole-4-carboxamide
CID 112697383
N-(4-ethyl-1H-pyrazol-5-yl)-1,3-dimethylpyrazole-4-carboxamide
CID 103738045
1-ethyl-N-(4-ethyl-1H-pyrazol-5-yl)-3-propan-2-ylpyrazole-5-carboxamide
CID 104620244
N-(4-ethyl-1H-pyrazol-5-yl)-4-nitro-1-propylpyrrole-2-carboxamide
CID 104620293
5-amino-N-(4-ethyl-1H-pyrazol-5-yl)-2-methoxybenzamide
CID 104616600
5-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1H-indazole-3-carboxamide
CID 104616617

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide?
The IUPAC name of 4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide (CID 104616582) is 4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide?
The canonical SMILES for 4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide is CCc1cn[nH]c1NC(=O)c1cc(N)cn1C.
What is the InChIKey of 4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide?
The InChIKey is KOGSCWVWUJQHJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-3-7-5-13-15-10(7)14-11(17)9-4-8(12)6-16(9)2/h4-6H,3,12H2,1-2H3,(H2,13,14,15,17).
What are the key properties of 4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide?
4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide has a molecular weight of 233.28 g/mol, XLogP of 1.15, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-ethyl-1H-pyrazol-5-yl)-1-methylpyrrole-2-carboxamide is sourced from PubChem (CID 104616582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).