2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide

C13H18N2O2 — CID 107074042

IUPAC2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide
SMILESNc1ccc(O)cc1C(=O)NCC1CCCC1
InChIInChI=1S/C13H18N2O2/c14-12-6-5-10(16)7-11(12)13(17)15-8-9-3-1-2-4-9/h5-7,9,16H,1-4,8,14H2,(H,15,17)
InChIKeyXCQNAUZOPMDBQQ-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.89
Rot. Bonds3

About 2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide

2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide (PubChem CID 107074042) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide.

Molecular Properties

Compound Name2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide
PubChem CID107074042
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide
SMILESNc1ccc(O)cc1C(=O)NCC1CCCC1
InChIInChI=1S/C13H18N2O2/c14-12-6-5-10(16)7-11(12)13(17)15-8-9-3-1-2-4-9/h5-7,9,16H,1-4,8,14H2,(H,15,17)
InChIKeyXCQNAUZOPMDBQQ-UHFFFAOYSA-N
XLogP1.89
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-[(1-ethylpiperidin-4-yl)methyl]-5-hydroxybenzamide
CID 107075001
2-amino-N-(cyclohexylmethyl)-5-fluorobenzamide
CID 43371580
2-amino-N-(cyclohexylmethyl)-5-nitrobenzamide
CID 62154778
2-amino-N-(cyclobutylmethyl)-5-nitrobenzamide
CID 62061126
2-amino-N-(cyclohexylmethyl)benzamide
CID 43215482
3-amino-N-(cyclobutylmethyl)naphthalene-2-carboxamide
CID 61209356
N-(cyclopropylmethyl)-2,4-dihydroxybenzamide
CID 103739641
2-amino-5-methyl-N-(oxan-4-ylmethyl)benzamide
CID 63707297
2-amino-5-bromo-N-[(4-hydroxycyclohexyl)methyl]benzamide
CID 106137131
3-amino-4-bromo-N-(cyclopentylmethyl)benzamide
CID 61095376
5-amino-2-chloro-N-(cyclohexylmethyl)benzamide
CID 43371364
4-[[(2-amino-5-bromobenzoyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 21470552

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide?
The IUPAC name of 2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide (CID 107074042) is 2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide.
What is the SMILES notation for 2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide?
The canonical SMILES for 2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide is Nc1ccc(O)cc1C(=O)NCC1CCCC1.
What is the InChIKey of 2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide?
The InChIKey is XCQNAUZOPMDBQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c14-12-6-5-10(16)7-11(12)13(17)15-8-9-3-1-2-4-9/h5-7,9,16H,1-4,8,14H2,(H,15,17).
What are the key properties of 2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide?
2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide has a molecular weight of 234.30 g/mol, XLogP of 1.89, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclopentylmethyl)-5-hydroxybenzamide is sourced from PubChem (CID 107074042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).