3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide

C19H20FN3O2 — CID 119740416

IUPAC3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide
SMILESNC1CCC(C(=O)Nc2cccc(C(=O)Nc3cccc(F)c3)c2)C1
InChIInChI=1S/C19H20FN3O2/c20-14-4-2-6-17(11-14)23-18(24)12-3-1-5-16(10-12)22-19(25)13-7-8-15(21)9-13/h1-6,10-11,13,15H,7-9,21H2,(H,22,25)(H,23,24)
InChIKeyZBPQXBDNHDPKFQ-UHFFFAOYSA-N
MW341.39 g/mol
LogP3.14
Rot. Bonds4

About 3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide

3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide (PubChem CID 119740416) has the molecular formula C19H20FN3O2 and a molecular weight of 341.39 g/mol. Its IUPAC name is 3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide.

Molecular Properties

Compound Name3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide
PubChem CID119740416
Molecular FormulaC19H20FN3O2
Molecular Weight341.39 g/mol
Exact Mass341.15
IUPAC Name3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide
SMILESNC1CCC(C(=O)Nc2cccc(C(=O)Nc3cccc(F)c3)c2)C1
InChIInChI=1S/C19H20FN3O2/c20-14-4-2-6-17(11-14)23-18(24)12-3-1-5-16(10-12)22-19(25)13-7-8-15(21)9-13/h1-6,10-11,13,15H,7-9,21H2,(H,22,25)(H,23,24)
InChIKeyZBPQXBDNHDPKFQ-UHFFFAOYSA-N
XLogP3.14
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 53.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(3-fluorophenyl)carbamoyl]phenyl]piperidine-4-carboxamide
CID 119298680
N-[3-[(3-aminocyclopentanecarbonyl)amino]phenyl]furan-3-carboxamide
CID 119761839
N-[3-[(3-aminocyclohexanecarbonyl)amino]phenyl]benzamide;hydrochloride
CID 119709587
trans-(1S,3S)-1-N,3-N-bis(3-fluorophenyl)cyclohexane-1,3-dicarboxamide
CID 7832111
cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide
CID 56906171
3-amino-N-[3-[(3-fluorophenyl)methoxy]phenyl]cyclopentane-1-carboxamide
CID 119739954
3-[(3-aminocyclopentanecarbonyl)amino]-N,N-diethylbenzamide
CID 119685393
N-(4-aminocyclohexyl)-3-(cyclopropanecarbonylamino)benzamide
CID 119477045
N-[3-[(3-fluorophenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 46634846
N-[4-(carbamoylamino)phenyl]-3-(cyclopropanecarbonylamino)benzamide
CID 33151643
N-[3-[(3-aminocyclopentanecarbonyl)amino]propyl]-3-fluorobenzamide;hydrochloride
CID 119783278
3-[(3-aminocyclopentanecarbonyl)amino]-N,N-diethylbenzamide;hydrochloride
CID 119685392

Frequently Asked Questions

What is the IUPAC name of 3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide?
The IUPAC name of 3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide (CID 119740416) is 3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide.
What is the SMILES notation for 3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide?
The canonical SMILES for 3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide is NC1CCC(C(=O)Nc2cccc(C(=O)Nc3cccc(F)c3)c2)C1.
What is the InChIKey of 3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide?
The InChIKey is ZBPQXBDNHDPKFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN3O2/c20-14-4-2-6-17(11-14)23-18(24)12-3-1-5-16(10-12)22-19(25)13-7-8-15(21)9-13/h1-6,10-11,13,15H,7-9,21H2,(H,22,25)(H,23,24).
What are the key properties of 3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide?
3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide has a molecular weight of 341.39 g/mol, XLogP of 3.14, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide is sourced from PubChem (CID 119740416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).