1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide

C12H15FN2O — CID 65463974

IUPAC1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide
SMILESNC1(C(=O)NCCc2ccccc2F)CC1
InChIInChI=1S/C12H15FN2O/c13-10-4-2-1-3-9(10)5-8-15-11(16)12(14)6-7-12/h1-4H,5-8,14H2,(H,15,16)
InChIKeyWTPYJNATBGPMKB-UHFFFAOYSA-N
MW222.26 g/mol
LogP0.98
Rot. Bonds4

About 1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide

1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide (PubChem CID 65463974) has the molecular formula C12H15FN2O and a molecular weight of 222.26 g/mol. Its IUPAC name is 1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide
PubChem CID65463974
Molecular FormulaC12H15FN2O
Molecular Weight222.26 g/mol
Exact Mass222.12
IUPAC Name1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide
SMILESNC1(C(=O)NCCc2ccccc2F)CC1
InChIInChI=1S/C12H15FN2O/c13-10-4-2-1-3-9(10)5-8-15-11(16)12(14)6-7-12/h1-4H,5-8,14H2,(H,15,16)
InChIKeyWTPYJNATBGPMKB-UHFFFAOYSA-N
XLogP0.98
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.26
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 60867022
1-amino-N-[2-(2,5-difluorophenyl)ethyl]cyclopropane-1-carboxamide
CID 115189941
N-[2-(2-fluorophenyl)ethyl]-1-[(E)-N'-hydroxycarbamimidoyl]cyclopropane-1-carboxamide
CID 80591512
1-N',1-N'-diethyl-1-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1,1-dicarboxamide
CID 108977349
2-(2-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 78792118
1-N'-(4-chlorophenyl)-1-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1,1-dicarboxamide
CID 108977390
N-[2-(2-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide
CID 78990913
2-amino-3,3,3-trifluoro-N-[2-(2-fluorophenyl)ethyl]-2-methylpropanamide
CID 79797317
1-N-[2-(3-chlorophenyl)ethyl]-1-N'-[2-(2-fluorophenyl)ethyl]cyclopropane-1,1-dicarboxamide
CID 108977360
1-N-[2-(2-fluorophenyl)ethyl]-1-N'-(2-morpholin-4-ylethyl)cyclopropane-1,1-dicarboxamide
CID 108973603
1-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 43529529
1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119296433

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide (CID 65463974) is 1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide is NC1(C(=O)NCCc2ccccc2F)CC1.
What is the InChIKey of 1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide?
The InChIKey is WTPYJNATBGPMKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O/c13-10-4-2-1-3-9(10)5-8-15-11(16)12(14)6-7-12/h1-4H,5-8,14H2,(H,15,16).
What are the key properties of 1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide?
1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide has a molecular weight of 222.26 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 65463974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).