5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide

C11H14ClN3O — CID 75973488

IUPAC5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide
SMILESCNC(=O)C1CC(c2ccccc2Cl)NN1
InChIInChI=1S/C11H14ClN3O/c1-13-11(16)10-6-9(14-15-10)7-4-2-3-5-8(7)12/h2-5,9-10,14-15H,6H2,1H3,(H,13,16)
InChIKeyLYEXGMRRDAVJRS-UHFFFAOYSA-N
MW239.71 g/mol
LogP0.99
Rot. Bonds2

About 5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide

5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide (PubChem CID 75973488) has the molecular formula C11H14ClN3O and a molecular weight of 239.71 g/mol. Its IUPAC name is 5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide.

Molecular Properties

Compound Name5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide
PubChem CID75973488
Molecular FormulaC11H14ClN3O
Molecular Weight239.71 g/mol
Exact Mass239.08
IUPAC Name5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide
SMILESCNC(=O)C1CC(c2ccccc2Cl)NN1
InChIInChI=1S/C11H14ClN3O/c1-13-11(16)10-6-9(14-15-10)7-4-2-3-5-8(7)12/h2-5,9-10,14-15H,6H2,1H3,(H,13,16)
InChIKeyLYEXGMRRDAVJRS-UHFFFAOYSA-N
XLogP0.99
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.71
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-chlorophenyl)-N-propan-2-ylpyrazolidine-3-carboxamide
CID 75138330
5-(2-chlorophenyl)-N-(4-iodophenyl)pyrazolidine-3-carboxamide
CID 75254788
N-(2-bromophenyl)-5-(2-chlorophenyl)pyrazolidine-3-carboxamide
CID 75254786
5-(2-chlorophenyl)-N-(3-methoxypropyl)pyrazolidine-3-carboxamide
CID 52978511
5-(2-chlorophenyl)-N-(1-methoxypropan-2-yl)pyrazolidine-3-carboxamide
CID 52978508
5-(2-chlorophenyl)-N-(2,4-dimethylphenyl)pyrazolidine-3-carboxamide
CID 75254752
methyl 4-[[5-(2-chlorophenyl)pyrazolidine-3-carbonyl]amino]benzoate
CID 74623743
5-(2-chlorophenyl)-N-(4-phenylbutan-2-yl)pyrazolidine-3-carboxamide
CID 75255190
5-(2-chlorophenyl)-N-[2-(trifluoromethyl)phenyl]pyrazolidine-3-carboxamide
CID 75254792
5-(2-chlorophenyl)-N-(3,4-difluorophenyl)pyrazolidine-3-carboxamide
CID 75254781
5-(2-chlorophenyl)-N-(2-fluoro-5-methylphenyl)pyrazolidine-3-carboxamide
CID 75254818
5-(2-chlorophenyl)-N-[(3,5-difluorophenyl)methyl]pyrazolidine-3-carboxamide
CID 75194339

Frequently Asked Questions

What is the IUPAC name of 5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide?
The IUPAC name of 5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide (CID 75973488) is 5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide.
What is the SMILES notation for 5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide?
The canonical SMILES for 5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide is CNC(=O)C1CC(c2ccccc2Cl)NN1.
What is the InChIKey of 5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide?
The InChIKey is LYEXGMRRDAVJRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O/c1-13-11(16)10-6-9(14-15-10)7-4-2-3-5-8(7)12/h2-5,9-10,14-15H,6H2,1H3,(H,13,16).
What are the key properties of 5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide?
5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide has a molecular weight of 239.71 g/mol, XLogP of 0.99, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chlorophenyl)-N-methylpyrazolidine-3-carboxamide is sourced from PubChem (CID 75973488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).