N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide

C18H25FN2O2 — CID 111432084

IUPACN-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide
SMILESO=C(CN(CC(O)c1ccc(F)cc1)C1CC1)NC1CCCC1
InChIInChI=1S/C18H25FN2O2/c19-14-7-5-13(6-8-14)17(22)11-21(16-9-10-16)12-18(23)20-15-3-1-2-4-15/h5-8,15-17,22H,1-4,9-12H2,(H,20,23)
InChIKeyWJBMDBMINNQCOB-UHFFFAOYSA-N
MW320.41 g/mol
LogP2.38
Rot. Bonds7

About N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide

N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide (PubChem CID 111432084) has the molecular formula C18H25FN2O2 and a molecular weight of 320.41 g/mol. Its IUPAC name is N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide
PubChem CID111432084
Molecular FormulaC18H25FN2O2
Molecular Weight320.41 g/mol
Exact Mass320.19
IUPAC NameN-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide
SMILESO=C(CN(CC(O)c1ccc(F)cc1)C1CC1)NC1CCCC1
InChIInChI=1S/C18H25FN2O2/c19-14-7-5-13(6-8-14)17(22)11-21(16-9-10-16)12-18(23)20-15-3-1-2-4-15/h5-8,15-17,22H,1-4,9-12H2,(H,20,23)
InChIKeyWJBMDBMINNQCOB-UHFFFAOYSA-N
XLogP2.38
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]-N-(1,3-thiazol-2-yl)acetamide
CID 111462226
2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]-N-(oxolan-2-ylmethyl)acetamide
CID 111753851
2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]-N-[1-(furan-2-yl)ethyl]acetamide
CID 111432073
N-cyclooctyl-2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]acetamide
CID 27106314
2-[cyclopropyl(prop-2-enyl)amino]-1-(4-fluorophenyl)ethanol
CID 71999867
2-chloro-N-cyclopentyl-2-(4-fluorophenyl)acetamide
CID 62224247
(1S)-2-[cyclopropyl-[[(2R)-oxolan-2-yl]methyl]amino]-1-(4-fluorophenyl)ethanol
CID 129424046
2-[(2-aminophenyl)methyl-cyclopropylamino]-N-cyclopentylacetamide
CID 43461001
2-[[2-(cyclohexylamino)-2-oxoethyl]-cyclopropylamino]acetic acid
CID 54945026
2-[cyclopentyl-(2-hydroxy-2-phenylethyl)amino]acetamide
CID 47284555
N-[3-[[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]methyl]phenyl]acetamide
CID 71999869
N-cyclopropyl-N-[2-(4-fluorophenyl)-2-hydroxyethyl]propane-1-sulfonamide
CID 75399763

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide?
The IUPAC name of N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide (CID 111432084) is N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide is O=C(CN(CC(O)c1ccc(F)cc1)C1CC1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide?
The InChIKey is WJBMDBMINNQCOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN2O2/c19-14-7-5-13(6-8-14)17(22)11-21(16-9-10-16)12-18(23)20-15-3-1-2-4-15/h5-8,15-17,22H,1-4,9-12H2,(H,20,23).
What are the key properties of N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide?
N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide has a molecular weight of 320.41 g/mol, XLogP of 2.38, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]acetamide is sourced from PubChem (CID 111432084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).