4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol

C16H26N2O — CID 63643806

IUPAC4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol
SMILESCCC(c1ccc(O)cc1)N(CC)C1CCCNC1
InChIInChI=1S/C16H26N2O/c1-3-16(13-7-9-15(19)10-8-13)18(4-2)14-6-5-11-17-12-14/h7-10,14,16-17,19H,3-6,11-12H2,1-2H3
InChIKeyGLSZYXGKADAVSL-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.92
Rot. Bonds5

About 4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol

4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol (PubChem CID 63643806) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol.

Molecular Properties

Compound Name4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol
PubChem CID63643806
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol
SMILESCCC(c1ccc(O)cc1)N(CC)C1CCCNC1
InChIInChI=1S/C16H26N2O/c1-3-16(13-7-9-15(19)10-8-13)18(4-2)14-6-5-11-17-12-14/h7-10,14,16-17,19H,3-6,11-12H2,1-2H3
InChIKeyGLSZYXGKADAVSL-UHFFFAOYSA-N
XLogP2.92
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[1-[piperidin-3-yl(propyl)amino]ethyl]phenol
CID 63636728
N-(1-phenylpropyl)-N-propylpiperidin-3-amine
CID 63638122
N-ethyl-N-[1-(4-ethylphenyl)ethyl]piperidin-3-amine
CID 63644319
2-[1-[ethyl(piperidin-3-yl)amino]ethyl]benzene-1,3-diol
CID 107711416
N-ethyl-N-(1-phenylethyl)piperidin-3-amine
CID 63643629
4-[[ethyl(piperidin-3-yl)amino]methyl]phenol
CID 63643977
N-(1-cyclopropylpropyl)-N-ethylpiperidin-3-amine
CID 64917233
N-ethyl-N-(3-methylbutan-2-yl)piperidin-3-amine
CID 63644152
2-[1-[ethyl(piperidin-3-yl)amino]ethyl]-5-fluorophenol
CID 63644320
N-ethyl-N-(3-methyl-1-phenylbutyl)pyrrolidin-3-amine
CID 63299236
N-[1-(3-bromophenyl)ethyl]-N-ethylpiperidin-3-amine
CID 63643987
4-(1-piperidin-3-ylethyl)phenol
CID 83908771

Frequently Asked Questions

What is the IUPAC name of 4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol?
The IUPAC name of 4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol (CID 63643806) is 4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol.
What is the SMILES notation for 4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol?
The canonical SMILES for 4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol is CCC(c1ccc(O)cc1)N(CC)C1CCCNC1.
What is the InChIKey of 4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol?
The InChIKey is GLSZYXGKADAVSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-16(13-7-9-15(19)10-8-13)18(4-2)14-6-5-11-17-12-14/h7-10,14,16-17,19H,3-6,11-12H2,1-2H3.
What are the key properties of 4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol?
4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol has a molecular weight of 262.40 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[ethyl(piperidin-3-yl)amino]propyl]phenol is sourced from PubChem (CID 63643806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).