N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine

C15H22Cl2N2O — CID 29285730

IUPACN-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine
SMILESCC(C)(CNCc1c(Cl)cccc1Cl)N1CCOCC1
InChIInChI=1S/C15H22Cl2N2O/c1-15(2,19-6-8-20-9-7-19)11-18-10-12-13(16)4-3-5-14(12)17/h3-5,18H,6-11H2,1-2H3
InChIKeyXPSNKEAEHZSBLM-UHFFFAOYSA-N
MW317.26 g/mol
LogP3.19
Rot. Bonds5

About N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine

N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine (PubChem CID 29285730) has the molecular formula C15H22Cl2N2O and a molecular weight of 317.26 g/mol. Its IUPAC name is N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound NameN-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine
PubChem CID29285730
Molecular FormulaC15H22Cl2N2O
Molecular Weight317.26 g/mol
Exact Mass316.11
IUPAC NameN-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine
SMILESCC(C)(CNCc1c(Cl)cccc1Cl)N1CCOCC1
InChIInChI=1S/C15H22Cl2N2O/c1-15(2,19-6-8-20-9-7-19)11-18-10-12-13(16)4-3-5-14(12)17/h3-5,18H,6-11H2,1-2H3
InChIKeyXPSNKEAEHZSBLM-UHFFFAOYSA-N
XLogP3.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.26
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-chlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 28643355
N-[(5-chlorothiophen-2-yl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 28643425
N-[(2-fluorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 28643365
N-[(2-bromo-4-chlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 81497365
2,4-dichloro-6-[[(2-methyl-2-morpholin-4-ylpropyl)amino]methyl]phenol
CID 29030381
N-[(2-methoxyphenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 28625170
2-methyl-2-morpholin-4-yl-N-[(3-nitrophenyl)methyl]propan-1-amine
CID 28643403
N-[(2,5-dimethylphenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 60658264
3-[(2,6-dichlorophenyl)methyl]-N-(2-methyl-2-morpholin-4-ylpropyl)-1,2,4-oxadiazole-5-carboxamide
CID 51053987
2-(2-chloroanilino)-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
CID 51252333
2-[[(2-chloro-6-morpholin-4-ylphenyl)methylamino]methyl]-2-ethylbutanoic acid
CID 122128310
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 60672705

Frequently Asked Questions

What is the IUPAC name of N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine?
The IUPAC name of N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine (CID 29285730) is N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine?
The canonical SMILES for N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine is CC(C)(CNCc1c(Cl)cccc1Cl)N1CCOCC1.
What is the InChIKey of N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine?
The InChIKey is XPSNKEAEHZSBLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Cl2N2O/c1-15(2,19-6-8-20-9-7-19)11-18-10-12-13(16)4-3-5-14(12)17/h3-5,18H,6-11H2,1-2H3.
What are the key properties of N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine?
N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine has a molecular weight of 317.26 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,6-dichlorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 29285730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).