1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide

C10H14N4O2 — CID 71897000

IUPAC1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCN1CC(C(=O)Nc2cnn(C)c2)CC1=O
InChIInChI=1S/C10H14N4O2/c1-13-5-7(3-9(13)15)10(16)12-8-4-11-14(2)6-8/h4,6-7H,3,5H2,1-2H3,(H,12,16)
InChIKeyCJKUHJVZNLKTQY-UHFFFAOYSA-N
MW222.25 g/mol
LogP-0.16
Rot. Bonds2

About 1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide

1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 71897000) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is 1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide
PubChem CID71897000
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC Name1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCN1CC(C(=O)Nc2cnn(C)c2)CC1=O
InChIInChI=1S/C10H14N4O2/c1-13-5-7(3-9(13)15)10(16)12-8-4-11-14(2)6-8/h4,6-7H,3,5H2,1-2H3,(H,12,16)
InChIKeyCJKUHJVZNLKTQY-UHFFFAOYSA-N
XLogP-0.16
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[2-(dimethylamino)-2-oxoethyl]pyrazol-4-yl]-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 146122980
1-(4-bromophenyl)-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide
CID 52995994
(3S)-1-(2,5-dimethoxyphenyl)-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide
CID 94022838
(3R)-1-[(2-chlorophenyl)methyl]-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide
CID 52899170
(3S)-1-(2-methoxy-5-methylphenyl)-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide
CID 94179751
N-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide
CID 112728864
(3R)-N-(3-chloro-4-fluorophenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 7357016
1-methyl-5-oxo-N-quinolin-3-ylpyrrolidine-3-carboxamide
CID 43926673
N-[4-(diethylamino)phenyl]-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 42956709
3-[(1-methylpyrazol-4-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63782962
(2R)-N-(1-methylpyrazol-4-yl)oxetane-2-carboxamide
CID 175500710
N-(3-ethyl-4-fluorophenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 146125472

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide (CID 71897000) is 1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide is CN1CC(C(=O)Nc2cnn(C)c2)CC1=O.
What is the InChIKey of 1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is CJKUHJVZNLKTQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c1-13-5-7(3-9(13)15)10(16)12-8-4-11-14(2)6-8/h4,6-7H,3,5H2,1-2H3,(H,12,16).
What are the key properties of 1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide?
1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 222.25 g/mol, XLogP of -0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 71897000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).