1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide

C14H17FN2O2 — CID 109130579

IUPAC1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide
SMILESCCCNC(=O)C1CC1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H17FN2O2/c1-2-6-16-13(18)11-8-12(11)14(19)17-10-5-3-4-9(15)7-10/h3-5,7,11-12H,2,6,8H2,1H3,(H,16,18)(H,17,19)
InChIKeyPADPFMITYXWGCA-UHFFFAOYSA-N
MW264.30 g/mol
LogP1.93
Rot. Bonds5

About 1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide

1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide (PubChem CID 109130579) has the molecular formula C14H17FN2O2 and a molecular weight of 264.30 g/mol. Its IUPAC name is 1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide
PubChem CID109130579
Molecular FormulaC14H17FN2O2
Molecular Weight264.30 g/mol
Exact Mass264.13
IUPAC Name1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide
SMILESCCCNC(=O)C1CC1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H17FN2O2/c1-2-6-16-13(18)11-8-12(11)14(19)17-10-5-3-4-9(15)7-10/h3-5,7,11-12H,2,6,8H2,1H3,(H,16,18)(H,17,19)
InChIKeyPADPFMITYXWGCA-UHFFFAOYSA-N
XLogP1.93
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-[2-(dimethylamino)ethyl]-1-N-(3-fluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109133778
1-N-(3,4-dimethylphenyl)-2-N-(3-fluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109141714
1-N-(3-cyanophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide
CID 109130608
2-N-(3-fluorophenyl)-1-N-(3-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141073
2-N-cyclopropyl-1-N-(3-fluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109130976
1-N-(3-acetamidophenyl)-2-N-[2-(4-fluorophenyl)ethyl]cyclopropane-1,2-dicarboxamide
CID 109137772
1-N-(3-fluorophenyl)-2-N-(4-methoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143442
2-N-butyl-1-N-(4-fluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109131322
1-N-(3,4-dichlorophenyl)-2-N-(3-fluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109144008
1-N-(3,5-dichlorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide
CID 109130600
(3S,5R)-5-amino-3-N-(3-fluorophenyl)-1-N-propylpiperidine-1,3-dicarboxamide
CID 166027296
1-N-(3-acetamidophenyl)-2-N-[(4-fluorophenyl)methyl]cyclopropane-1,2-dicarboxamide
CID 109136122

Frequently Asked Questions

What is the IUPAC name of 1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide?
The IUPAC name of 1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide (CID 109130579) is 1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide?
The canonical SMILES for 1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide is CCCNC(=O)C1CC1C(=O)Nc1cccc(F)c1.
What is the InChIKey of 1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide?
The InChIKey is PADPFMITYXWGCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O2/c1-2-6-16-13(18)11-8-12(11)14(19)17-10-5-3-4-9(15)7-10/h3-5,7,11-12H,2,6,8H2,1H3,(H,16,18)(H,17,19).
What are the key properties of 1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide?
1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide has a molecular weight of 264.30 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(3-fluorophenyl)-2-N-propylcyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109130579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).