N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide

C14H19ClN2O2 — CID 106737723

IUPACN-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide
SMILESNCC(NC(=O)c1cc(Cl)ccc1O)C1CCCC1
InChIInChI=1S/C14H19ClN2O2/c15-10-5-6-13(18)11(7-10)14(19)17-12(8-16)9-3-1-2-4-9/h5-7,9,12,18H,1-4,8,16H2,(H,17,19)
InChIKeyKVVAXUIMJONVEV-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.29
Rot. Bonds4

About N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide

N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide (PubChem CID 106737723) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide
PubChem CID106737723
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC NameN-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide
SMILESNCC(NC(=O)c1cc(Cl)ccc1O)C1CCCC1
InChIInChI=1S/C14H19ClN2O2/c15-10-5-6-13(18)11(7-10)14(19)17-12(8-16)9-3-1-2-4-9/h5-7,9,12,18H,1-4,8,16H2,(H,17,19)
InChIKeyKVVAXUIMJONVEV-UHFFFAOYSA-N
XLogP2.29
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide?
The IUPAC name of N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide (CID 106737723) is N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide.
What is the SMILES notation for N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide?
The canonical SMILES for N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide is NCC(NC(=O)c1cc(Cl)ccc1O)C1CCCC1.
What is the InChIKey of N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide?
The InChIKey is KVVAXUIMJONVEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c15-10-5-6-13(18)11(7-10)14(19)17-12(8-16)9-3-1-2-4-9/h5-7,9,12,18H,1-4,8,16H2,(H,17,19).
What are the key properties of N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide?
N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide has a molecular weight of 282.77 g/mol, XLogP of 2.29, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopentylethyl)-5-chloro-2-hydroxybenzamide is sourced from PubChem (CID 106737723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).