5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol

C15H23NO3 — CID 103082952

IUPAC5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol
SMILESCOc1ccc(C(C)NC2CCC(OC)C2)c(O)c1
InChIInChI=1S/C15H23NO3/c1-10(16-11-4-5-12(8-11)18-2)14-7-6-13(19-3)9-15(14)17/h6-7,9-12,16-17H,4-5,8H2,1-3H3
InChIKeyMEZXYRUOKNFHNZ-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.62
Rot. Bonds5

About 5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol

5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol (PubChem CID 103082952) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol.

Molecular Properties

Compound Name5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol
PubChem CID103082952
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol
SMILESCOc1ccc(C(C)NC2CCC(OC)C2)c(O)c1
InChIInChI=1S/C15H23NO3/c1-10(16-11-4-5-12(8-11)18-2)14-7-6-13(19-3)9-15(14)17/h6-7,9-12,16-17H,4-5,8H2,1-3H3
InChIKeyMEZXYRUOKNFHNZ-UHFFFAOYSA-N
XLogP2.62
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[1-(cycloheptylamino)ethyl]-5-methoxyphenol
CID 43202473
5-methoxy-2-[1-[(1-propan-2-ylpiperidin-4-yl)amino]ethyl]phenol
CID 43206678
5-[1-(2-hydroxy-4-methoxyphenyl)ethylamino]piperidin-2-one
CID 63663146
2-[1-[(2-hydroxycyclohexyl)amino]ethyl]-5-methoxyphenol
CID 55064076
2-[1-[(3-methoxycyclobutyl)amino]ethyl]phenol
CID 104584456
5-methoxy-2-[1-[(2,2,3,3-tetramethylcyclopropyl)amino]ethyl]phenol
CID 79357914
2-[1-[(3-methoxycyclopentyl)amino]ethyl]naphthalen-1-ol
CID 103083012
2-[1-[(2,6-dimethylpiperidin-1-yl)amino]ethyl]-5-methoxyphenol
CID 83007109
N-[1-(2,4-dimethoxyphenyl)ethyl]-3-ethoxycyclobutan-1-amine
CID 115903402
4-[[(1R)-1-(2-fluoro-4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol
CID 98264241
2-[1-[(1,3-dimethylpiperidin-4-yl)amino]ethyl]-5-methoxyphenol
CID 104582308
3-methoxy-N-[(1S)-1-(4-methoxyphenyl)ethyl]cyclobutan-1-amine
CID 106821544

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol?
The IUPAC name of 5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol (CID 103082952) is 5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol.
What is the SMILES notation for 5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol?
The canonical SMILES for 5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol is COc1ccc(C(C)NC2CCC(OC)C2)c(O)c1.
What is the InChIKey of 5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol?
The InChIKey is MEZXYRUOKNFHNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-10(16-11-4-5-12(8-11)18-2)14-7-6-13(19-3)9-15(14)17/h6-7,9-12,16-17H,4-5,8H2,1-3H3.
What are the key properties of 5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol?
5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol has a molecular weight of 265.35 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-[1-[(3-methoxycyclopentyl)amino]ethyl]phenol is sourced from PubChem (CID 103082952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).