N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide

C12H15ClN2O2 — CID 63251551

IUPACN-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide
SMILESNC1CCCC1NC(=O)c1ccc(O)c(Cl)c1
InChIInChI=1S/C12H15ClN2O2/c13-8-6-7(4-5-11(8)16)12(17)15-10-3-1-2-9(10)14/h4-6,9-10,16H,1-3,14H2,(H,15,17)
InChIKeyRYZVSMJPJOJRSZ-UHFFFAOYSA-N
MW254.72 g/mol
LogP1.66
Rot. Bonds2

About N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide

N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide (PubChem CID 63251551) has the molecular formula C12H15ClN2O2 and a molecular weight of 254.72 g/mol. Its IUPAC name is N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide
PubChem CID63251551
Molecular FormulaC12H15ClN2O2
Molecular Weight254.72 g/mol
Exact Mass254.08
IUPAC NameN-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide
SMILESNC1CCCC1NC(=O)c1ccc(O)c(Cl)c1
InChIInChI=1S/C12H15ClN2O2/c13-8-6-7(4-5-11(8)16)12(17)15-10-3-1-2-9(10)14/h4-6,9-10,16H,1-3,14H2,(H,15,17)
InChIKeyRYZVSMJPJOJRSZ-UHFFFAOYSA-N
XLogP1.66
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.72
LogP ≤ 51.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide?
The IUPAC name of N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide (CID 63251551) is N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide.
What is the SMILES notation for N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide?
The canonical SMILES for N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide is NC1CCCC1NC(=O)c1ccc(O)c(Cl)c1.
What is the InChIKey of N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide?
The InChIKey is RYZVSMJPJOJRSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2O2/c13-8-6-7(4-5-11(8)16)12(17)15-10-3-1-2-9(10)14/h4-6,9-10,16H,1-3,14H2,(H,15,17).
What are the key properties of N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide?
N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide has a molecular weight of 254.72 g/mol, XLogP of 1.66, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide is sourced from PubChem (CID 63251551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).