N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide

C13H14FNO — CID 53016800

IUPACN-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide
SMILESO=C(NC1CC1)C1(c2ccccc2F)CC1
InChIInChI=1S/C13H14FNO/c14-11-4-2-1-3-10(11)13(7-8-13)12(16)15-9-5-6-9/h1-4,9H,5-8H2,(H,15,16)
InChIKeyHNUWBBFBUBGFCF-UHFFFAOYSA-N
MW219.26 g/mol
LogP2.14
Rot. Bonds3

About N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide

N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide (PubChem CID 53016800) has the molecular formula C13H14FNO and a molecular weight of 219.26 g/mol. Its IUPAC name is N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide
PubChem CID53016800
Molecular FormulaC13H14FNO
Molecular Weight219.26 g/mol
Exact Mass219.11
IUPAC NameN-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide
SMILESO=C(NC1CC1)C1(c2ccccc2F)CC1
InChIInChI=1S/C13H14FNO/c14-11-4-2-1-3-10(11)13(7-8-13)12(16)15-9-5-6-9/h1-4,9H,5-8H2,(H,15,16)
InChIKeyHNUWBBFBUBGFCF-UHFFFAOYSA-N
XLogP2.14
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 139020107
1-(2-fluorophenyl)-N-[(3S,4R)-3-hydroxyoxan-4-yl]cyclopropane-1-carboxamide
CID 91762806
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1-(2-fluorophenyl)-N-[3-[6-(methylamino)pyrimidin-4-yl]cyclobutyl]cyclopropane-1-carboxamide
CID 91785443
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CID 47908630
2-[[1-(2-fluorophenyl)cyclopropanecarbonyl]amino]acetic acid
CID 110466030
1-(4-bromo-2-fluorophenyl)-N-cyclohexylcyclopropane-1-carboxamide
CID 69259424
[2-(cyclopentylamino)-2-oxoethyl] 1-(2-fluorophenyl)cyclopentane-1-carboxylate
CID 8661548
[2-(cycloheptylamino)-2-oxoethyl] 1-(2-fluorophenyl)cyclopentane-1-carboxylate
CID 23932612
1-(2-fluorophenyl)-N-(2-hydroxyethyl)cyclopentane-1-carboxamide
CID 110438309

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
The IUPAC name of N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide (CID 53016800) is N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide is O=C(NC1CC1)C1(c2ccccc2F)CC1.
What is the InChIKey of N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
The InChIKey is HNUWBBFBUBGFCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FNO/c14-11-4-2-1-3-10(11)13(7-8-13)12(16)15-9-5-6-9/h1-4,9H,5-8H2,(H,15,16).
What are the key properties of N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide has a molecular weight of 219.26 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(2-fluorophenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 53016800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).