[4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol

C14H21ClN2O2 — CID 102932163

IUPAC[4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(C(CN)c2cccc(Cl)c2)CC(CO)O1
InChIInChI=1S/C14H21ClN2O2/c1-10-7-17(8-13(9-18)19-10)14(6-16)11-3-2-4-12(15)5-11/h2-5,10,13-14,18H,6-9,16H2,1H3
InChIKeyMWFLIHJCPFGBLO-UHFFFAOYSA-N
MW284.79 g/mol
LogP1.42
Rot. Bonds4

About [4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol

[4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol (PubChem CID 102932163) has the molecular formula C14H21ClN2O2 and a molecular weight of 284.79 g/mol. Its IUPAC name is [4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol
PubChem CID102932163
Molecular FormulaC14H21ClN2O2
Molecular Weight284.79 g/mol
Exact Mass284.13
IUPAC Name[4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(C(CN)c2cccc(Cl)c2)CC(CO)O1
InChIInChI=1S/C14H21ClN2O2/c1-10-7-17(8-13(9-18)19-10)14(6-16)11-3-2-4-12(15)5-11/h2-5,10,13-14,18H,6-9,16H2,1H3
InChIKeyMWFLIHJCPFGBLO-UHFFFAOYSA-N
XLogP1.42
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-(3,5-dichlorophenyl)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]ethanamine
CID 124552555
2-(3-chlorophenyl)-2-(2-ethylmorpholin-4-yl)ethanamine
CID 43562487
1-[2-amino-1-(3-chlorophenyl)ethyl]-4-methylpiperidin-3-ol
CID 102956061
[4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol
CID 102932218
(2S)-2-(3-chlorophenyl)-2-(4-methylpiperidin-1-yl)ethanamine
CID 93489474
[4-[2-amino-1-(3-methylphenyl)propyl]-6-methylmorpholin-2-yl]methanol
CID 102932113
[4-[(3-chlorophenyl)methyl]-6-methylmorpholin-2-yl]methanol
CID 102935440
2-(2,6-dimethylmorpholin-4-yl)-2-naphthalen-2-ylethanamine
CID 16782210
1-[2-amino-1-(3-chlorophenyl)ethyl]pyrrolidine-3-carboxamide
CID 114081770
2-(3-chlorophenyl)-2-(3-ethyl-4-methylpiperazin-1-yl)ethanamine
CID 63603993
2-(4-butan-2-ylpiperazin-1-yl)-2-(3-chlorophenyl)ethanamine
CID 62773618
[4-[2-amino-1-(3-methoxyphenyl)ethyl]morpholin-2-yl]methanol
CID 81206167

Frequently Asked Questions

What is the IUPAC name of [4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol (CID 102932163) is [4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol is CC1CN(C(CN)c2cccc(Cl)c2)CC(CO)O1.
What is the InChIKey of [4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol?
The InChIKey is MWFLIHJCPFGBLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O2/c1-10-7-17(8-13(9-18)19-10)14(6-16)11-3-2-4-12(15)5-11/h2-5,10,13-14,18H,6-9,16H2,1H3.
What are the key properties of [4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol?
[4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol has a molecular weight of 284.79 g/mol, XLogP of 1.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 102932163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).