4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide

C10H13FN4O — CID 76852826

IUPAC4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide
SMILESNC1CNNC1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C10H13FN4O/c11-6-1-3-7(4-2-6)14-10(16)9-8(12)5-13-15-9/h1-4,8-9,13,15H,5,12H2,(H,14,16)
InChIKeyYDDSZGWJKKDGFE-UHFFFAOYSA-N
MW224.24 g/mol
LogP-0.43
Rot. Bonds2

About 4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide

4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide (PubChem CID 76852826) has the molecular formula C10H13FN4O and a molecular weight of 224.24 g/mol. Its IUPAC name is 4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide
PubChem CID76852826
Molecular FormulaC10H13FN4O
Molecular Weight224.24 g/mol
Exact Mass224.11
IUPAC Name4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide
SMILESNC1CNNC1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C10H13FN4O/c11-6-1-3-7(4-2-6)14-10(16)9-8(12)5-13-15-9/h1-4,8-9,13,15H,5,12H2,(H,14,16)
InChIKeyYDDSZGWJKKDGFE-UHFFFAOYSA-N
XLogP-0.43
TPSA79.18 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.24
LogP ≤ 5-0.43
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(4-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670661
N-(4-fluorophenyl)cyclopropanecarboxamide
CID 532027
N-(4-fluorophenyl)pyrazolidine-3-carboxamide
CID 75220517
3-amino-N-(4-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670664
(2S)-1-N,2-N-bis(4-fluorophenyl)-3-methylidenecyclopropane-1,2-dicarboxamide
CID 21177965
2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide
CID 144539030
4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide
CID 109150302
N-(4-fluorophenyl)piperazine-2-carboxamide
CID 63103447
N-(4-fluorophenyl)-2-methylpyrrolidine-3-carboxamide
CID 79382751
(1S,4Z,8S)-N-(4-fluorophenyl)bicyclo[6.1.0]non-4-ene-9-carboxamide
CID 5415413
N-[4-(difluoromethoxy)phenyl]-3-(4-fluorophenyl)pyrazolidine-4-carboxamide
CID 75209970
N-[4-(azepan-1-ylsulfonyl)phenyl]-4-iodopyrazolidine-3-carboxamide
CID 78376937

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide?
The IUPAC name of 4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide (CID 76852826) is 4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide.
What is the SMILES notation for 4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide?
The canonical SMILES for 4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide is NC1CNNC1C(=O)Nc1ccc(F)cc1.
What is the InChIKey of 4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide?
The InChIKey is YDDSZGWJKKDGFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN4O/c11-6-1-3-7(4-2-6)14-10(16)9-8(12)5-13-15-9/h1-4,8-9,13,15H,5,12H2,(H,14,16).
What are the key properties of 4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide?
4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide has a molecular weight of 224.24 g/mol, XLogP of -0.43, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-fluorophenyl)pyrazolidine-3-carboxamide is sourced from PubChem (CID 76852826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).