[2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol

C17H26N2O — CID 79545669

IUPAC[2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol
SMILESOCc1ccccc1NC1CCCC1C1CCCCN1
InChIInChI=1S/C17H26N2O/c20-12-13-6-1-2-8-15(13)19-17-10-5-7-14(17)16-9-3-4-11-18-16/h1-2,6,8,14,16-20H,3-5,7,9-12H2
InChIKeyQBYCHAUIXBVTCW-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.90
Rot. Bonds4

About [2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol

[2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol (PubChem CID 79545669) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is [2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol.

Molecular Properties

Compound Name[2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol
PubChem CID79545669
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name[2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol
SMILESOCc1ccccc1NC1CCCC1C1CCCCN1
InChIInChI=1S/C17H26N2O/c20-12-13-6-1-2-8-15(13)19-17-10-5-7-14(17)16-9-3-4-11-18-16/h1-2,6,8,14,16-20H,3-5,7,9-12H2
InChIKeyQBYCHAUIXBVTCW-UHFFFAOYSA-N
XLogP2.90
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol?
The IUPAC name of [2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol (CID 79545669) is [2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol.
What is the SMILES notation for [2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol?
The canonical SMILES for [2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol is OCc1ccccc1NC1CCCC1C1CCCCN1.
What is the InChIKey of [2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol?
The InChIKey is QBYCHAUIXBVTCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c20-12-13-6-1-2-8-15(13)19-17-10-5-7-14(17)16-9-3-4-11-18-16/h1-2,6,8,14,16-20H,3-5,7,9-12H2.
What are the key properties of [2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol?
[2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol has a molecular weight of 274.41 g/mol, XLogP of 2.90, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-piperidin-2-ylcyclopentyl)amino]phenyl]methanol is sourced from PubChem (CID 79545669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).