(2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine

C14H20Cl2N2O — CID 79665565

IUPAC(2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCC(C)N1CCOC(C(N)c2cccc(Cl)c2Cl)C1
InChIInChI=1S/C14H20Cl2N2O/c1-9(2)18-6-7-19-12(8-18)14(17)10-4-3-5-11(15)13(10)16/h3-5,9,12,14H,6-8,17H2,1-2H3
InChIKeyXMQLGWVPNJRHNB-UHFFFAOYSA-N
MW303.23 g/mol
LogP3.10
Rot. Bonds3

About (2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine

(2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine (PubChem CID 79665565) has the molecular formula C14H20Cl2N2O and a molecular weight of 303.23 g/mol. Its IUPAC name is (2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine.

Molecular Properties

Compound Name(2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
PubChem CID79665565
Molecular FormulaC14H20Cl2N2O
Molecular Weight303.23 g/mol
Exact Mass302.10
IUPAC Name(2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCC(C)N1CCOC(C(N)c2cccc(Cl)c2Cl)C1
InChIInChI=1S/C14H20Cl2N2O/c1-9(2)18-6-7-19-12(8-18)14(17)10-4-3-5-11(15)13(10)16/h3-5,9,12,14H,6-8,17H2,1-2H3
InChIKeyXMQLGWVPNJRHNB-UHFFFAOYSA-N
XLogP3.10
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.23
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dichlorophenyl)-N-methyl-1-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79662870
phenyl-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79665183
(2-ethoxyphenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79664711
2-(2-chlorophenyl)-1-(4-propan-2-ylmorpholin-2-yl)ethanamine
CID 79665755
[4-[1-(2,3-dichlorophenyl)ethyl]morpholin-2-yl]methanamine
CID 114079708
[2-(3-chloro-2-fluorophenyl)-1-(4-propan-2-ylmorpholin-2-yl)ethyl]hydrazine
CID 102867978
(3-cyclobutylphenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 114603947
(3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 114688564
(4-propan-2-ylmorpholin-2-yl)-(2-propylpyrazol-3-yl)methanamine
CID 79664704
(2,3-dichlorophenyl)-(2-methyloxolan-3-yl)methanamine
CID 115851414
(3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 104515903
(4-propan-2-ylmorpholin-2-yl)-quinolin-3-ylmethanamine
CID 79665562

Frequently Asked Questions

What is the IUPAC name of (2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The IUPAC name of (2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine (CID 79665565) is (2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine.
What is the SMILES notation for (2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The canonical SMILES for (2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine is CC(C)N1CCOC(C(N)c2cccc(Cl)c2Cl)C1.
What is the InChIKey of (2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The InChIKey is XMQLGWVPNJRHNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Cl2N2O/c1-9(2)18-6-7-19-12(8-18)14(17)10-4-3-5-11(15)13(10)16/h3-5,9,12,14H,6-8,17H2,1-2H3.
What are the key properties of (2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
(2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine has a molecular weight of 303.23 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine is sourced from PubChem (CID 79665565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).