2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol

C16H26N2O — CID 61237683

IUPAC2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol
SMILESCC(C)N1CCC(Nc2ccc(CCO)cc2)CC1
InChIInChI=1S/C16H26N2O/c1-13(2)18-10-7-16(8-11-18)17-15-5-3-14(4-6-15)9-12-19/h3-6,13,16-17,19H,7-12H2,1-2H3
InChIKeyUTAAMOVJTMSVLM-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.51
Rot. Bonds5

About 2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol

2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol (PubChem CID 61237683) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol
PubChem CID61237683
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol
SMILESCC(C)N1CCC(Nc2ccc(CCO)cc2)CC1
InChIInChI=1S/C16H26N2O/c1-13(2)18-10-7-16(8-11-18)17-15-5-3-14(4-6-15)9-12-19/h3-6,13,16-17,19H,7-12H2,1-2H3
InChIKeyUTAAMOVJTMSVLM-UHFFFAOYSA-N
XLogP2.51
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 ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]acetonitrile
CID 43722185
2-[4-[(4-tert-butylcyclohexyl)amino]phenyl]ethanol
CID 61237684
N-ethyl-4-[(1-propan-2-ylpiperidin-4-yl)amino]benzamide
CID 43728511
tert-butyl (4S)-4-[4-(2-hydroxyethyl)anilino]azepane-1-carboxylate
CID 99853020
6-hydroxy-3-[4-[(1-propan-2-ylpiperidin-4-yl)amino]anilino]piperidin-2-one
CID 164535728
N-(4-chlorophenyl)-1-(4-phenylbutan-2-yl)piperidin-4-amine
CID 4005434
1-methyl-5-[(1-propan-2-ylpiperidin-4-yl)amino]pyridin-2-one
CID 54866098
2-[4-(1-cyclohexylethylamino)phenyl]ethanol
CID 61239115
N-(4-bromo-3-iodophenyl)-1-propan-2-ylpiperidin-4-amine
CID 114259571
N-(4-bromo-3-fluorophenyl)-1-propan-2-ylpiperidin-4-amine
CID 65432364
N-(3-ethylphenyl)-1-propan-2-ylazepan-4-amine
CID 65072849
2-N,2-N-dimethyl-5-N-(1-propan-2-ylpiperidin-4-yl)pyridine-2,5-diamine
CID 43690467

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol?
The IUPAC name of 2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol (CID 61237683) is 2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol.
What is the SMILES notation for 2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol?
The canonical SMILES for 2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol is CC(C)N1CCC(Nc2ccc(CCO)cc2)CC1.
What is the InChIKey of 2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol?
The InChIKey is UTAAMOVJTMSVLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-13(2)18-10-7-16(8-11-18)17-15-5-3-14(4-6-15)9-12-19/h3-6,13,16-17,19H,7-12H2,1-2H3.
What are the key properties of 2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol?
2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol has a molecular weight of 262.40 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]phenyl]ethanol is sourced from PubChem (CID 61237683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).