5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide

C14H18N6O — CID 77042902

IUPAC5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide
SMILESNC1CC(C(=O)Nc2cnn(Cc3ccccc3)c2)NN1
InChIInChI=1S/C14H18N6O/c15-13-6-12(18-19-13)14(21)17-11-7-16-20(9-11)8-10-4-2-1-3-5-10/h1-5,7,9,12-13,18-19H,6,8,15H2,(H,17,21)
InChIKeyVERDVIYBJXKNAJ-UHFFFAOYSA-N
MW286.34 g/mol
LogP0.02
Rot. Bonds4

About 5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide

5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide (PubChem CID 77042902) has the molecular formula C14H18N6O and a molecular weight of 286.34 g/mol. Its IUPAC name is 5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide.

Molecular Properties

Compound Name5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide
PubChem CID77042902
Molecular FormulaC14H18N6O
Molecular Weight286.34 g/mol
Exact Mass286.15
IUPAC Name5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide
SMILESNC1CC(C(=O)Nc2cnn(Cc3ccccc3)c2)NN1
InChIInChI=1S/C14H18N6O/c15-13-6-12(18-19-13)14(21)17-11-7-16-20(9-11)8-10-4-2-1-3-5-10/h1-5,7,9,12-13,18-19H,6,8,15H2,(H,17,21)
InChIKeyVERDVIYBJXKNAJ-UHFFFAOYSA-N
XLogP0.02
TPSA97.00 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 50.02
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-N-(1-benzylpyrazol-4-yl)piperidine-2-carboxamide;hydrochloride
CID 119740026
N-(1-benzylpyrazol-4-yl)-2-hydroxycyclopentane-1-carboxamide
CID 110014209
N-(1-benzylpyrazol-4-yl)pyrrolidine-3-carboxamide
CID 63006125
N-(1-benzylpyrazol-4-yl)piperidine-3-carboxamide
CID 60946173
(2S,5R)-5-(aminomethyl)-N-(1-benzylpyrazol-4-yl)oxolane-2-carboxamide
CID 120788956
3-[(1-benzylpyrazol-4-yl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
CID 3439709
3-[(1-benzylpyrazol-4-yl)amino]propanoic acid
CID 82539638
N-(1-benzylpyrazol-4-yl)-3-tert-butyl-4,5-dihydro-1,2-oxazole-5-carboxamide
CID 166358020
N-(1-benzylpyrazol-4-yl)-3-chloropropanamide
CID 54867188
3-N-(1-benzylpyrazol-4-yl)cyclopentane-1,3-diamine
CID 79462283
(3S)-N-(1-benzylpyrazol-4-yl)-3-hydroxypyrrolidine-1-carboxamide
CID 111521201
N-(1-benzylpyrazol-4-yl)-2-(4-chloropyrazol-1-yl)acetamide
CID 19397538

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide?
The IUPAC name of 5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide (CID 77042902) is 5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide.
What is the SMILES notation for 5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide?
The canonical SMILES for 5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide is NC1CC(C(=O)Nc2cnn(Cc3ccccc3)c2)NN1.
What is the InChIKey of 5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide?
The InChIKey is VERDVIYBJXKNAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6O/c15-13-6-12(18-19-13)14(21)17-11-7-16-20(9-11)8-10-4-2-1-3-5-10/h1-5,7,9,12-13,18-19H,6,8,15H2,(H,17,21).
What are the key properties of 5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide?
5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide has a molecular weight of 286.34 g/mol, XLogP of 0.02, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(1-benzylpyrazol-4-yl)pyrazolidine-3-carboxamide is sourced from PubChem (CID 77042902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).