1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol

C14H21ClN2O — CID 60910522

IUPAC1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol
SMILESCN1CCC(NCC(O)c2ccccc2Cl)CC1
InChIInChI=1S/C14H21ClN2O/c1-17-8-6-11(7-9-17)16-10-14(18)12-4-2-3-5-13(12)15/h2-5,11,14,16,18H,6-10H2,1H3
InChIKeySYAXUAAYSKHDRE-UHFFFAOYSA-N
MW268.79 g/mol
LogP2.06
Rot. Bonds4

About 1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol

1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol (PubChem CID 60910522) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol
PubChem CID60910522
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC Name1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol
SMILESCN1CCC(NCC(O)c2ccccc2Cl)CC1
InChIInChI=1S/C14H21ClN2O/c1-17-8-6-11(7-9-17)16-10-14(18)12-4-2-3-5-13(12)15/h2-5,11,14,16,18H,6-10H2,1H3
InChIKeySYAXUAAYSKHDRE-UHFFFAOYSA-N
XLogP2.06
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-chlorophenyl)-2-[(1-methylsulfonylpiperidin-4-yl)amino]ethanol
CID 60908981
1-(2-chlorophenyl)-2-[(3,3,5,5-tetramethylcyclohexyl)amino]ethanol
CID 103966216
1-(2-chlorophenyl)-2-[(3-ethoxycyclobutyl)amino]ethanol
CID 103917765
(1R)-1-(2-chlorophenyl)-2-[[(6R)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]ethanol
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1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol
CID 60910521
1-(2-chlorophenyl)-2-[(2,6-dimethylpiperidin-1-yl)amino]ethanol
CID 83013771
1-[(1-methylpiperidin-4-yl)amino]-3-phenylpropan-2-ol
CID 111755497
N-[(2,6-dichlorophenyl)methyl]-1-methylpiperidin-4-amine
CID 43215915
5-[[2-(2-chlorophenyl)-2-hydroxyethyl]amino]piperidin-2-one
CID 63661920
1-(2-chlorophenyl)-2-(cyclopropylmethylamino)ethanol
CID 60903428
N-[2-(2-chlorophenyl)ethyl]-1-methylpiperidin-4-amine
CID 23931096
2-(2-chlorophenyl)-2-(1-methylpiperidin-4-yl)ethanol
CID 115008578

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol?
The IUPAC name of 1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol (CID 60910522) is 1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol.
What is the SMILES notation for 1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol?
The canonical SMILES for 1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol is CN1CCC(NCC(O)c2ccccc2Cl)CC1.
What is the InChIKey of 1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol?
The InChIKey is SYAXUAAYSKHDRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O/c1-17-8-6-11(7-9-17)16-10-14(18)12-4-2-3-5-13(12)15/h2-5,11,14,16,18H,6-10H2,1H3.
What are the key properties of 1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol?
1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol has a molecular weight of 268.79 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol is sourced from PubChem (CID 60910522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).