N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide

C13H18N2O2 — CID 143616752

IUPACN-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide
SMILESNc1ccc(NC(=O)C2CCCCC2)cc1O
InChIInChI=1S/C13H18N2O2/c14-11-7-6-10(8-12(11)16)15-13(17)9-4-2-1-3-5-9/h6-9,16H,1-5,14H2,(H,15,17)
InChIKeyPPURZOGGTULSIJ-UHFFFAOYSA-N
MW234.30 g/mol
LogP2.49
Rot. Bonds2

About N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide

N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide (PubChem CID 143616752) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide
PubChem CID143616752
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide
SMILESNc1ccc(NC(=O)C2CCCCC2)cc1O
InChIInChI=1S/C13H18N2O2/c14-11-7-6-10(8-12(11)16)15-13(17)9-4-2-1-3-5-9/h6-9,16H,1-5,14H2,(H,15,17)
InChIKeyPPURZOGGTULSIJ-UHFFFAOYSA-N
XLogP2.49
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 52.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-amino-3-bromophenyl)cycloheptanecarboxamide
CID 82861556
N-(4-amino-3-bromophenyl)cyclohexanecarboxamide
CID 82861844
N-(3-amino-4-bromophenyl)cyclohexanecarboxamide
CID 79767895
N-(4-chloro-3-hydroxyphenyl)cyclooctanecarboxamide
CID 65023340
N-[4-(cyclopropanecarbonylamino)phenyl]cyclohexanecarboxamide
CID 25276011
N-(3-amino-4-methoxyphenyl)cyclooctanecarboxamide
CID 65023208
N-(4-hydroxyphenyl)cycloheptanecarboxamide
CID 62589451
N-[4-(cyclohexanecarbonylamino)-2-hydroxyphenyl]benzamide
CID 17363024
2-chloro-5-(cycloheptanecarbonylamino)benzoic acid
CID 62587194
2-chloro-5-(cyclooctanecarbonylamino)benzoic acid
CID 65019289
N-(4-amino-2-hydroxyphenyl)cyclohexanecarboxamide
CID 53338609
N-(3-fluoro-4-hydroxyphenyl)cyclobutanecarboxamide
CID 64781438

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide?
The IUPAC name of N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide (CID 143616752) is N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide.
What is the SMILES notation for N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide?
The canonical SMILES for N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide is Nc1ccc(NC(=O)C2CCCCC2)cc1O.
What is the InChIKey of N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide?
The InChIKey is PPURZOGGTULSIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c14-11-7-6-10(8-12(11)16)15-13(17)9-4-2-1-3-5-9/h6-9,16H,1-5,14H2,(H,15,17).
What are the key properties of N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide?
N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide has a molecular weight of 234.30 g/mol, XLogP of 2.49, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-3-hydroxyphenyl)cyclohexanecarboxamide is sourced from PubChem (CID 143616752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).