N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide

C14H16FN3O3 — CID 174516227

IUPACN-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide
SMILESO=CNNC(=O)C1CCCN(C(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C14H16FN3O3/c15-12-5-3-10(4-6-12)14(21)18-7-1-2-11(8-18)13(20)17-16-9-19/h3-6,9,11H,1-2,7-8H2,(H,16,19)(H,17,20)
InChIKeyOSXTYHBJOXDNMT-UHFFFAOYSA-N
MW293.30 g/mol
LogP0.46
Rot. Bonds4

About N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide

N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide (PubChem CID 174516227) has the molecular formula C14H16FN3O3 and a molecular weight of 293.30 g/mol. Its IUPAC name is N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide.

Molecular Properties

Compound NameN-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide
PubChem CID174516227
Molecular FormulaC14H16FN3O3
Molecular Weight293.30 g/mol
Exact Mass293.12
IUPAC NameN-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide
SMILESO=CNNC(=O)C1CCCN(C(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C14H16FN3O3/c15-12-5-3-10(4-6-12)14(21)18-7-1-2-11(8-18)13(20)17-16-9-19/h3-6,9,11H,1-2,7-8H2,(H,16,19)(H,17,20)
InChIKeyOSXTYHBJOXDNMT-UHFFFAOYSA-N
XLogP0.46
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.30
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(3R)-N-cyclopentyl-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 25392682
1-(4-fluorobenzoyl)piperidine-3-carbohydrazide
CID 54793956
1-(4-fluorobenzoyl)-N-methylpiperidine-3-carboxamide
CID 47128312
[(3R)-1-(4-fluorobenzoyl)piperidin-3-yl]-piperidin-1-ylmethanone
CID 936701
(3S)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 68704612
1-(4-fluorobenzoyl)-N-(3-hydroxypropyl)piperidine-3-carboxamide
CID 78854856
N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 51272463
1-(4-fluorobenzoyl)-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide
CID 24534971
N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 51272015
1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide
CID 51273264
(4-aminopiperidin-1-yl)-[1-(4-fluorobenzoyl)piperidin-3-yl]methanone
CID 119372894
1-(4-fluorobenzoyl)-N'-hydroxypiperidine-3-carboximidamide
CID 77041850

Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide?
The IUPAC name of N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide (CID 174516227) is N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide.
What is the SMILES notation for N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide?
The canonical SMILES for N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide is O=CNNC(=O)C1CCCN(C(=O)c2ccc(F)cc2)C1.
What is the InChIKey of N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide?
The InChIKey is OSXTYHBJOXDNMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O3/c15-12-5-3-10(4-6-12)14(21)18-7-1-2-11(8-18)13(20)17-16-9-19/h3-6,9,11H,1-2,7-8H2,(H,16,19)(H,17,20).
What are the key properties of N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide?
N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide has a molecular weight of 293.30 g/mol, XLogP of 0.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide is sourced from PubChem (CID 174516227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).