4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol

C18H28N2O — CID 79536288

IUPAC4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol
SMILESOc1ccc(CCNC2CCCC2C2CCCCN2)cc1
InChIInChI=1S/C18H28N2O/c21-15-9-7-14(8-10-15)11-13-20-18-6-3-4-16(18)17-5-1-2-12-19-17/h7-10,16-21H,1-6,11-13H2
InChIKeyDDMXUFJSFVQHLY-UHFFFAOYSA-N
MW288.43 g/mol
LogP2.84
Rot. Bonds5

About 4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol

4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol (PubChem CID 79536288) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is 4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol.

Molecular Properties

Compound Name4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol
PubChem CID79536288
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC Name4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol
SMILESOc1ccc(CCNC2CCCC2C2CCCCN2)cc1
InChIInChI=1S/C18H28N2O/c21-15-9-7-14(8-10-15)11-13-20-18-6-3-4-16(18)17-5-1-2-12-19-17/h7-10,16-21H,1-6,11-13H2
InChIKeyDDMXUFJSFVQHLY-UHFFFAOYSA-N
XLogP2.84
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 52.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-piperidin-2-yl-N-(2-thiophen-3-ylethyl)cyclopentan-1-amine
CID 79545243
4-[(2-piperidin-2-ylcyclopentyl)amino]phenol
CID 79545447
N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 79537931
4-[(2-piperidin-2-ylcyclohexyl)amino]phenol
CID 79553578
N-[2-(2-methylpyrazol-3-yl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 103004984
4-[2-[[(1S,2R)-2-hydroxycyclohexyl]amino]ethyl]phenol
CID 129394205
3-[(2-piperidin-2-ylcyclopentyl)amino]propan-1-ol
CID 79544914
N-benzyl-2-piperidin-2-ylcyclopentan-1-amine
CID 79545054
N-[2-(1-methylpyrazol-3-yl)ethyl]-2-piperidin-2-ylcyclohexan-1-amine
CID 106104216
4-[2-[(2-tert-butylcyclohexyl)amino]ethyl]phenol
CID 61236716
N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 106899423
2-piperidin-2-yl-N-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine
CID 106426945

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol?
The IUPAC name of 4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol (CID 79536288) is 4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol.
What is the SMILES notation for 4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol?
The canonical SMILES for 4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol is Oc1ccc(CCNC2CCCC2C2CCCCN2)cc1.
What is the InChIKey of 4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol?
The InChIKey is DDMXUFJSFVQHLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c21-15-9-7-14(8-10-15)11-13-20-18-6-3-4-16(18)17-5-1-2-12-19-17/h7-10,16-21H,1-6,11-13H2.
What are the key properties of 4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol?
4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol has a molecular weight of 288.43 g/mol, XLogP of 2.84, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol is sourced from PubChem (CID 79536288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).