4-[(cyclopentyloxyamino)methyl]phenol

C12H17NO2 — CID 83229024

IUPAC4-[(cyclopentyloxyamino)methyl]phenol
SMILESOc1ccc(CNOC2CCCC2)cc1
InChIInChI=1S/C12H17NO2/c14-11-7-5-10(6-8-11)9-13-15-12-3-1-2-4-12/h5-8,12-14H,1-4,9H2
InChIKeyKQJWCPDOZIFKFJ-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.36
Rot. Bonds4

About 4-[(cyclopentyloxyamino)methyl]phenol

4-[(cyclopentyloxyamino)methyl]phenol (PubChem CID 83229024) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 4-[(cyclopentyloxyamino)methyl]phenol.

Molecular Properties

Compound Name4-[(cyclopentyloxyamino)methyl]phenol
PubChem CID83229024
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name4-[(cyclopentyloxyamino)methyl]phenol
SMILESOc1ccc(CNOC2CCCC2)cc1
InChIInChI=1S/C12H17NO2/c14-11-7-5-10(6-8-11)9-13-15-12-3-1-2-4-12/h5-8,12-14H,1-4,9H2
InChIKeyKQJWCPDOZIFKFJ-UHFFFAOYSA-N
XLogP2.36
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-Hydroxybenzylamine
CID 97472
4-[2-(Methoxyamino)ethyl]phenol
CID 20476240
4-(1-Aminoethyl)phenol
CID 123594
4-(3-Aminoprop-1-en-2-yl)phenol
CID 13737682
4-(Aminomethyl)-3-fluorophenol hydrochloride
CID 22058439
4-(1-Amino-2-hydroxyethyl)phenol hydrochloride
CID 70405192
N-nitrosohydroxylamine N-substituted, 6
CID 135757115
4-(Aminomethyl)-3-fluorophenol
CID 20872623
4-(Aminomethyl)-2-fluorophenol
CID 43657610
4-(Aminomethyl)-2-fluorophenol hydrobromide
CID 53532668
4-(Aminomethyl)-3-iodophenol hydrobromide
CID 170918240
4-[2-(Hydroxyamino)ethyl]phenol
CID 19076942

Frequently Asked Questions

What is the IUPAC name of 4-[(cyclopentyloxyamino)methyl]phenol?
The IUPAC name of 4-[(cyclopentyloxyamino)methyl]phenol (CID 83229024) is 4-[(cyclopentyloxyamino)methyl]phenol.
What is the SMILES notation for 4-[(cyclopentyloxyamino)methyl]phenol?
The canonical SMILES for 4-[(cyclopentyloxyamino)methyl]phenol is Oc1ccc(CNOC2CCCC2)cc1.
What is the InChIKey of 4-[(cyclopentyloxyamino)methyl]phenol?
The InChIKey is KQJWCPDOZIFKFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c14-11-7-5-10(6-8-11)9-13-15-12-3-1-2-4-12/h5-8,12-14H,1-4,9H2.
What are the key properties of 4-[(cyclopentyloxyamino)methyl]phenol?
4-[(cyclopentyloxyamino)methyl]phenol has a molecular weight of 207.27 g/mol, XLogP of 2.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(cyclopentyloxyamino)methyl]phenol is sourced from PubChem (CID 83229024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).