N-(5-aminopentyl)-4-hydroxybenzamide

C12H18N2O2 — CID 11459592

IUPACN-(5-aminopentyl)-4-hydroxybenzamide
SMILESNCCCCCNC(=O)c1ccc(O)cc1
InChIInChI=1S/C12H18N2O2/c13-8-2-1-3-9-14-12(16)10-4-6-11(15)7-5-10/h4-7,15H,1-3,8-9,13H2,(H,14,16)
InChIKeyYAUDROZIHBGOKR-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.25
Rot. Bonds6

About N-(5-aminopentyl)-4-hydroxybenzamide

N-(5-aminopentyl)-4-hydroxybenzamide (PubChem CID 11459592) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N-(5-aminopentyl)-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(5-aminopentyl)-4-hydroxybenzamide
PubChem CID11459592
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN-(5-aminopentyl)-4-hydroxybenzamide
SMILESNCCCCCNC(=O)c1ccc(O)cc1
InChIInChI=1S/C12H18N2O2/c13-8-2-1-3-9-14-12(16)10-4-6-11(15)7-5-10/h4-7,15H,1-3,8-9,13H2,(H,14,16)
InChIKeyYAUDROZIHBGOKR-UHFFFAOYSA-N
XLogP1.25
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[3-[4-[3-(3-aminopropylamino)propylamino]butylamino]propyl]-4-hydroxybenzamide
CID 101205073
N-decyl-4-hydroxybenzamide
CID 15277871
7-[(4-hydroxybenzoyl)amino]heptanoic acid
CID 24691793
4-N-(3-aminopropyl)benzene-1,4-dicarboxamide
CID 11053215
4-chloro-N-[8-[(4-chlorobenzoyl)amino]octyl]benzamide
CID 3606775
ethyl 6-[(4-hydroxybenzoyl)amino]hexanoate
CID 23657410
1-N,4-N-bis(2-aminoethyl)benzene-1,4-dicarboxamide
CID 58098446
N-(4-aminobutyl)-4-(3-aminoprop-1-ynyl)benzamide
CID 172548745
lithium 4-[(4-hydroxybenzoyl)amino]butanoate
CID 142769153
N-(6-aminohexyl)-4-(1,3-dihydroisoindol-2-yl)benzamide
CID 141337083
N-(6-aminohexyl)-1,3-benzoxazole-5-carboxamide
CID 108795126
4-hydroxy-N-(4-hydroxypentyl)benzamide
CID 107300182

Frequently Asked Questions

What is the IUPAC name of N-(5-aminopentyl)-4-hydroxybenzamide?
The IUPAC name of N-(5-aminopentyl)-4-hydroxybenzamide (CID 11459592) is N-(5-aminopentyl)-4-hydroxybenzamide.
What is the SMILES notation for N-(5-aminopentyl)-4-hydroxybenzamide?
The canonical SMILES for N-(5-aminopentyl)-4-hydroxybenzamide is NCCCCCNC(=O)c1ccc(O)cc1.
What is the InChIKey of N-(5-aminopentyl)-4-hydroxybenzamide?
The InChIKey is YAUDROZIHBGOKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c13-8-2-1-3-9-14-12(16)10-4-6-11(15)7-5-10/h4-7,15H,1-3,8-9,13H2,(H,14,16).
What are the key properties of N-(5-aminopentyl)-4-hydroxybenzamide?
N-(5-aminopentyl)-4-hydroxybenzamide has a molecular weight of 222.29 g/mol, XLogP of 1.25, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-aminopentyl)-4-hydroxybenzamide is sourced from PubChem (CID 11459592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).