4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol

C15H23NO2 — CID 113322903

IUPAC4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol
SMILESCC(Cc1ccc(O)cc1)NCC1CCCC1O
InChIInChI=1S/C15H23NO2/c1-11(9-12-5-7-14(17)8-6-12)16-10-13-3-2-4-15(13)18/h5-8,11,13,15-18H,2-4,9-10H2,1H3
InChIKeyWGNPRVUZGATJCW-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.07
Rot. Bonds5

About 4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol

4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol (PubChem CID 113322903) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol.

Molecular Properties

Compound Name4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol
PubChem CID113322903
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol
SMILESCC(Cc1ccc(O)cc1)NCC1CCCC1O
InChIInChI=1S/C15H23NO2/c1-11(9-12-5-7-14(17)8-6-12)16-10-13-3-2-4-15(13)18/h5-8,11,13,15-18H,2-4,9-10H2,1H3
InChIKeyWGNPRVUZGATJCW-UHFFFAOYSA-N
XLogP2.07
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[1-(4-methoxyphenyl)propan-2-ylamino]methyl]cyclohexan-1-ol
CID 64928817
4-[2-(cyclobutylamino)propyl]phenol
CID 115494316
2-[(propan-2-ylamino)methyl]cyclopentan-1-ol
CID 13133892
4-[2-(oxolan-3-ylmethylamino)propyl]phenol
CID 115494210
4-[2-(thiolan-3-ylmethylamino)propyl]phenol
CID 107166188
4-[2-[(1-ethylpyrrolidin-3-yl)methylamino]propyl]phenol
CID 115494201
4-[2-[2-(3-methylcyclohexyl)ethylamino]propyl]phenol
CID 115494364
2-[(pentan-2-ylamino)methyl]cyclohexan-1-ol
CID 64927417
2-[[1-(4-ethylphenyl)ethylamino]methyl]cyclohexan-1-ol
CID 64928037
4-[2-(2-cyclohexyloxyethylamino)propyl]phenol
CID 115494352
4-[2-[(1-propylcyclopropyl)methylamino]propyl]phenol
CID 114099628
4-[(2-hydroxycyclohexyl)methyl]phenol
CID 54410536

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol?
The IUPAC name of 4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol (CID 113322903) is 4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol.
What is the SMILES notation for 4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol?
The canonical SMILES for 4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol is CC(Cc1ccc(O)cc1)NCC1CCCC1O.
What is the InChIKey of 4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol?
The InChIKey is WGNPRVUZGATJCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-11(9-12-5-7-14(17)8-6-12)16-10-13-3-2-4-15(13)18/h5-8,11,13,15-18H,2-4,9-10H2,1H3.
What are the key properties of 4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol?
4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol has a molecular weight of 249.35 g/mol, XLogP of 2.07, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2-hydroxycyclopentyl)methylamino]propyl]phenol is sourced from PubChem (CID 113322903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).