2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide

C14H19FN2O2 — CID 62662448

IUPAC2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide
SMILESNc1c(F)cccc1C(=O)N(CCO)C1CCCC1
InChIInChI=1S/C14H19FN2O2/c15-12-7-3-6-11(13(12)16)14(19)17(8-9-18)10-4-1-2-5-10/h3,6-7,10,18H,1-2,4-5,8-9,16H2
InChIKeyJCIWYVOLIQDIGH-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.78
Rot. Bonds4

About 2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide

2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide (PubChem CID 62662448) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is 2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide
PubChem CID62662448
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC Name2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide
SMILESNc1c(F)cccc1C(=O)N(CCO)C1CCCC1
InChIInChI=1S/C14H19FN2O2/c15-12-7-3-6-11(13(12)16)14(19)17(8-9-18)10-4-1-2-5-10/h3,6-7,10,18H,1-2,4-5,8-9,16H2
InChIKeyJCIWYVOLIQDIGH-UHFFFAOYSA-N
XLogP1.78
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-2-fluoro-N-(2-hydroxyethyl)benzamide
CID 54942691
2-amino-3-chloro-N-cyclobutyl-N-(2-hydroxyethyl)benzamide
CID 102858927
3-amino-N-cyclopentyl-N-(2-hydroxyethyl)-2-methylbenzamide
CID 61115530
2-amino-3-chloro-N-cyclopropyl-N-(2-hydroxyethyl)benzamide
CID 115540101
3-bromo-N-cyclohexyl-2-fluoro-N-(2-hydroxyethyl)benzamide
CID 106547829
N-cyclopentyl-2,3,4-trifluoro-N-(2-hydroxyethyl)benzamide
CID 79749875
2-amino-N-benzyl-N-cyclopropyl-3-fluorobenzamide
CID 81499537
2-amino-N-cyclobutyl-5-fluoro-N-(2-hydroxyethyl)benzamide
CID 102858956
N-cyclohexyl-2-fluoro-N-(2-hydroxyethyl)-5-methylbenzamide
CID 62510137
N-cyclopentyl-5-fluoro-2-hydroxy-N-(2-hydroxyethyl)benzamide
CID 115298997
N-cyclopentyl-N-ethyl-2,3-difluorobenzamide
CID 55101771
3-(2-amino-N-cyclobutyl-3-fluoroanilino)propan-1-ol
CID 102859346

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide?
The IUPAC name of 2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide (CID 62662448) is 2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for 2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide is Nc1c(F)cccc1C(=O)N(CCO)C1CCCC1.
What is the InChIKey of 2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide?
The InChIKey is JCIWYVOLIQDIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c15-12-7-3-6-11(13(12)16)14(19)17(8-9-18)10-4-1-2-5-10/h3,6-7,10,18H,1-2,4-5,8-9,16H2.
What are the key properties of 2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide?
2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide has a molecular weight of 266.32 g/mol, XLogP of 1.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopentyl-3-fluoro-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 62662448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).