(1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol

C12H18ClNO2 — CID 59261616

IUPAC(1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol
SMILESCOCCN(C)C[C@H](O)c1ccc(Cl)cc1
InChIInChI=1S/C12H18ClNO2/c1-14(7-8-16-2)9-12(15)10-3-5-11(13)6-4-10/h3-6,12,15H,7-9H2,1-2H3/t12-/m0/s1
InChIKeyRMWSAMNMRXWQAX-LBPRGKRZSA-N
MW243.73 g/mol
LogP1.95
Rot. Bonds6

About (1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol

(1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol (PubChem CID 59261616) has the molecular formula C12H18ClNO2 and a molecular weight of 243.73 g/mol. Its IUPAC name is (1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol.

Molecular Properties

Compound Name(1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol
PubChem CID59261616
Molecular FormulaC12H18ClNO2
Molecular Weight243.73 g/mol
Exact Mass243.10
IUPAC Name(1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol
SMILESCOCCN(C)C[C@H](O)c1ccc(Cl)cc1
InChIInChI=1S/C12H18ClNO2/c1-14(7-8-16-2)9-12(15)10-3-5-11(13)6-4-10/h3-6,12,15H,7-9H2,1-2H3/t12-/m0/s1
InChIKeyRMWSAMNMRXWQAX-LBPRGKRZSA-N
XLogP1.95
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.73
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol?
The IUPAC name of (1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol (CID 59261616) is (1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol.
What is the SMILES notation for (1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol?
The canonical SMILES for (1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol is COCCN(C)C[C@H](O)c1ccc(Cl)cc1.
What is the InChIKey of (1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol?
The InChIKey is RMWSAMNMRXWQAX-LBPRGKRZSA-N. The full InChI is InChI=1S/C12H18ClNO2/c1-14(7-8-16-2)9-12(15)10-3-5-11(13)6-4-10/h3-6,12,15H,7-9H2,1-2H3/t12-/m0/s1.
What are the key properties of (1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol?
(1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol has a molecular weight of 243.73 g/mol, XLogP of 1.95, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(4-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol is sourced from PubChem (CID 59261616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).