1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine

C17H27FN2O — CID 79057627

IUPAC1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine
SMILESCCC(C)(C(Cc1ccccc1F)NC)N1CCOCC1
InChIInChI=1S/C17H27FN2O/c1-4-17(2,20-9-11-21-12-10-20)16(19-3)13-14-7-5-6-8-15(14)18/h5-8,16,19H,4,9-13H2,1-3H3
InChIKeyOSJZIAVVEWZUKC-UHFFFAOYSA-N
MW294.41 g/mol
LogP2.46
Rot. Bonds6

About 1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine

1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine (PubChem CID 79057627) has the molecular formula C17H27FN2O and a molecular weight of 294.41 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine
PubChem CID79057627
Molecular FormulaC17H27FN2O
Molecular Weight294.41 g/mol
Exact Mass294.21
IUPAC Name1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine
SMILESCCC(C)(C(Cc1ccccc1F)NC)N1CCOCC1
InChIInChI=1S/C17H27FN2O/c1-4-17(2,20-9-11-21-12-10-20)16(19-3)13-14-7-5-6-8-15(14)18/h5-8,16,19H,4,9-13H2,1-3H3
InChIKeyOSJZIAVVEWZUKC-UHFFFAOYSA-N
XLogP2.46
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.41
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(2-fluorophenyl)-3-methyl-3-morpholin-4-ylpentan-2-yl]hydrazine
CID 105241498
3-[3-methyl-2-(methylamino)-3-morpholin-4-ylpentyl]pyridin-2-amine
CID 79057851
N-ethyl-1-(2-fluorophenyl)-3-methyl-3-morpholin-4-ylbutan-2-amine
CID 79051761
[3-methyl-1-(2-methylphenyl)-3-morpholin-4-ylpentan-2-yl]hydrazine
CID 105241505
(3-methyl-3-morpholin-4-yl-1-phenylpentan-2-yl)hydrazine
CID 105241429
3-(azepan-1-yl)-1-(2-fluorophenyl)-N,3-dimethylbutan-2-amine
CID 79051510
1-(5-bromo-3-pyridinyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine
CID 104802978
N-[(2-fluorophenyl)methyl]-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 28643365
[1-(2-chlorophenyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-yl]hydrazine
CID 105241133
1-(5-ethylthiophen-2-yl)-N,3-dimethyl-3-pyrrolidin-1-ylpentan-2-amine
CID 79068652
1-(3-chloro-2-fluorophenyl)-3-methyl-3-morpholin-4-ylpentan-2-amine
CID 102857723
1-(4-bromo-2-fluorophenyl)-3-methyl-3-morpholin-4-ylpentan-2-amine
CID 79057613

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine?
The IUPAC name of 1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine (CID 79057627) is 1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine?
The canonical SMILES for 1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine is CCC(C)(C(Cc1ccccc1F)NC)N1CCOCC1.
What is the InChIKey of 1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine?
The InChIKey is OSJZIAVVEWZUKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27FN2O/c1-4-17(2,20-9-11-21-12-10-20)16(19-3)13-14-7-5-6-8-15(14)18/h5-8,16,19H,4,9-13H2,1-3H3.
What are the key properties of 1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine?
1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine has a molecular weight of 294.41 g/mol, XLogP of 2.46, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine is sourced from PubChem (CID 79057627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).