2-[1-(cyclopentyloxyamino)propyl]phenol

C14H21NO2 — CID 83229678

IUPAC2-[1-(cyclopentyloxyamino)propyl]phenol
SMILESCCC(NOC1CCCC1)c1ccccc1O
InChIInChI=1S/C14H21NO2/c1-2-13(12-9-5-6-10-14(12)16)15-17-11-7-3-4-8-11/h5-6,9-11,13,15-16H,2-4,7-8H2,1H3
InChIKeyOVAVEXDLVMHCST-UHFFFAOYSA-N
MW235.33 g/mol
LogP3.31
Rot. Bonds5

About 2-[1-(cyclopentyloxyamino)propyl]phenol

2-[1-(cyclopentyloxyamino)propyl]phenol (PubChem CID 83229678) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-[1-(cyclopentyloxyamino)propyl]phenol.

Molecular Properties

Compound Name2-[1-(cyclopentyloxyamino)propyl]phenol
PubChem CID83229678
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-[1-(cyclopentyloxyamino)propyl]phenol
SMILESCCC(NOC1CCCC1)c1ccccc1O
InChIInChI=1S/C14H21NO2/c1-2-13(12-9-5-6-10-14(12)16)15-17-11-7-3-4-8-11/h5-6,9-11,13,15-16H,2-4,7-8H2,1H3
InChIKeyOVAVEXDLVMHCST-UHFFFAOYSA-N
XLogP3.31
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-cyclopentyloxy-1-phenylpropan-1-amine
CID 83228943
2-[1-(methoxyamino)propyl]phenol
CID 82706320
2-[1-(cyclopropylamino)propyl]phenol
CID 16772826
2-[1-(3-cyclopentylpropylamino)propyl]phenol
CID 106008970
2-[1-(methylamino)propyl]phenol
CID 12862798
2-[(1S)-1-(cyclopent-3-en-1-ylamino)propyl]phenol
CID 99632914
2-[(1R)-1-[[1-[(1S,2S)-2-hydroxycyclohexyl]piperidin-4-yl]amino]propyl]phenol
CID 99702928
cis-(1R,2S)-2-[[(1S)-1-(2-hydroxyphenyl)propyl]amino]-N-methylcyclohexane-1-carboxamide
CID 124862264
2-[1-(oxan-3-ylamino)propyl]phenol
CID 63359773
2-[1-[(2-cyclopropyl-2-hydroxyethyl)amino]propyl]phenol
CID 63294662
2-[1-[(3-methylsulfanylcyclohexyl)amino]propyl]phenol
CID 104924871
1-(2-chlorophenyl)-N-cyclopentyloxyethanamine
CID 83228544

Frequently Asked Questions

What is the IUPAC name of 2-[1-(cyclopentyloxyamino)propyl]phenol?
The IUPAC name of 2-[1-(cyclopentyloxyamino)propyl]phenol (CID 83229678) is 2-[1-(cyclopentyloxyamino)propyl]phenol.
What is the SMILES notation for 2-[1-(cyclopentyloxyamino)propyl]phenol?
The canonical SMILES for 2-[1-(cyclopentyloxyamino)propyl]phenol is CCC(NOC1CCCC1)c1ccccc1O.
What is the InChIKey of 2-[1-(cyclopentyloxyamino)propyl]phenol?
The InChIKey is OVAVEXDLVMHCST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-2-13(12-9-5-6-10-14(12)16)15-17-11-7-3-4-8-11/h5-6,9-11,13,15-16H,2-4,7-8H2,1H3.
What are the key properties of 2-[1-(cyclopentyloxyamino)propyl]phenol?
2-[1-(cyclopentyloxyamino)propyl]phenol has a molecular weight of 235.33 g/mol, XLogP of 3.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(cyclopentyloxyamino)propyl]phenol is sourced from PubChem (CID 83229678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).