N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide

C11H18N4O — CID 103908575

IUPACN-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide
SMILESCCc1nn(C)cc1NC(=O)N1CCCC1
InChIInChI=1S/C11H18N4O/c1-3-9-10(8-14(2)13-9)12-11(16)15-6-4-5-7-15/h8H,3-7H2,1-2H3,(H,12,16)
InChIKeyDWBLOPDHDCENDB-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.61
Rot. Bonds2

About N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide

N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide (PubChem CID 103908575) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide
PubChem CID103908575
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC NameN-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide
SMILESCCc1nn(C)cc1NC(=O)N1CCCC1
InChIInChI=1S/C11H18N4O/c1-3-9-10(8-14(2)13-9)12-11(16)15-6-4-5-7-15/h8H,3-7H2,1-2H3,(H,12,16)
InChIKeyDWBLOPDHDCENDB-UHFFFAOYSA-N
XLogP1.61
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(1,5-dimethyl-1H-pyrazol-4-yl)-N-methyl-N-[3-(1-methyl-1H-pyrazol-4-yl)propyl]urea
CID 72864285
N-(cyclopropylmethyl)-2-[(3-ethyl-1-methylpyrazol-4-yl)carbamoylamino]acetamide
CID 75448424
1-[(1S)-1-(cyclohexen-1-yl)ethyl]-3-(1-ethyl-3-methylpyrazol-4-yl)urea
CID 97433597
3-ethyl-1-methyl-N-[(3-methyltriazol-4-yl)methyl]pyrazol-4-amine
CID 115898011
N-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-N'-[(1-methyl-1H-pyrazol-4-yl)methyl]urea
CID 118762532
3-cyano-N-[5-cyclopropyl-1-(2-methylpropyl)pyrazol-4-yl]-3-methylazetidine-1-carboxamide
CID 128404468
1-(2-Fluoroethyl)-3-(1-methyl-3-propan-2-ylpyrazol-4-yl)urea
CID 132384581
1-[2-(3,3-Dimethylpyrrolidin-1-yl)ethyl]-3-(1-methyl-3-propan-2-ylpyrazol-4-yl)urea
CID 138025189
N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-4-[(2-oxoimidazolidin-1-yl)methyl]piperidine-1-carboxamide
CID 138025197
1-(3-ethyl-1-methylpyrazol-4-yl)-3-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methyl]urea
CID 164629892
(5S)-N-(1-butyl-5-propan-2-ylpyrazol-4-yl)-1,7-diazaspiro[4.4]nonane-1-carboxamide
CID 164630927
3-[1-[(2S)-butan-2-yl]-5-methylpyrazol-4-yl]-1-ethyl-1-(2-methylprop-2-enyl)urea
CID 164631155

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide (CID 103908575) is N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide is CCc1nn(C)cc1NC(=O)N1CCCC1.
What is the InChIKey of N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide?
The InChIKey is DWBLOPDHDCENDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-3-9-10(8-14(2)13-9)12-11(16)15-6-4-5-7-15/h8H,3-7H2,1-2H3,(H,12,16).
What are the key properties of N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide?
N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 103908575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).