2-(cyclopropylmethyl)-2-fluorohexanamide

C10H18FNO — CID 70182828

IUPAC2-(cyclopropylmethyl)-2-fluorohexanamide
SMILESCCCCC(F)(CC1CC1)C(N)=O
InChIInChI=1S/C10H18FNO/c1-2-3-6-10(11,9(12)13)7-8-4-5-8/h8H,2-7H2,1H3,(H2,12,13)
InChIKeyLFPIJVIVVIYTEG-UHFFFAOYSA-N
MW187.26 g/mol
LogP2.17
Rot. Bonds6

About 2-(cyclopropylmethyl)-2-fluorohexanamide

2-(cyclopropylmethyl)-2-fluorohexanamide (PubChem CID 70182828) has the molecular formula C10H18FNO and a molecular weight of 187.26 g/mol. Its IUPAC name is 2-(cyclopropylmethyl)-2-fluorohexanamide.

Molecular Properties

Compound Name2-(cyclopropylmethyl)-2-fluorohexanamide
PubChem CID70182828
Molecular FormulaC10H18FNO
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC Name2-(cyclopropylmethyl)-2-fluorohexanamide
SMILESCCCCC(F)(CC1CC1)C(N)=O
InChIInChI=1S/C10H18FNO/c1-2-3-6-10(11,9(12)13)7-8-4-5-8/h8H,2-7H2,1H3,(H2,12,13)
InChIKeyLFPIJVIVVIYTEG-UHFFFAOYSA-N
XLogP2.17
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[[4-(2-carboxy-2-ethylhexyl)cyclohexyl]methyl]-2-ethylhexanoic acid
CID 70237933
2-fluoro-2-propan-2-ylhexanamide
CID 54054711
2-fluoro-2-methylpentanamide
CID 134346431
methyl 2-(aminomethyl)-2-(cyclopropylmethyl)heptanoate
CID 106489994
2-(cyclopropylmethyl)-2-methylhexanal
CID 141352242
butyl 4-(2,2,3,3,3-pentafluoropropyl)cyclohexane-1-carboxylate
CID 89114370
(2S)-2-[(Z)-but-2-enyl]-2-fluorooctanamide;ethane;methylcyclopentane;molecular hydrogen
CID 177059179
2-(cyclobutylmethyl)-2-ethylhexanoic acid
CID 79425365
2-(cyclopropylmethylamino)-2-methylpentanamide
CID 55026560
(2S)-4-cyclopropyl-2-hydroxy-2-methylbutanamide
CID 89267071
2-fluoro-2-propan-2-ylheptanamide
CID 139916526
2-butyl-2-(5-carbamoylnonan-5-ylamino)hexanamide
CID 173317820

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethyl)-2-fluorohexanamide?
The IUPAC name of 2-(cyclopropylmethyl)-2-fluorohexanamide (CID 70182828) is 2-(cyclopropylmethyl)-2-fluorohexanamide.
What is the SMILES notation for 2-(cyclopropylmethyl)-2-fluorohexanamide?
The canonical SMILES for 2-(cyclopropylmethyl)-2-fluorohexanamide is CCCCC(F)(CC1CC1)C(N)=O.
What is the InChIKey of 2-(cyclopropylmethyl)-2-fluorohexanamide?
The InChIKey is LFPIJVIVVIYTEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO/c1-2-3-6-10(11,9(12)13)7-8-4-5-8/h8H,2-7H2,1H3,(H2,12,13).
What are the key properties of 2-(cyclopropylmethyl)-2-fluorohexanamide?
2-(cyclopropylmethyl)-2-fluorohexanamide has a molecular weight of 187.26 g/mol, XLogP of 2.17, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethyl)-2-fluorohexanamide is sourced from PubChem (CID 70182828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).