3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine

C15H14FNOS — CID 162139870

IUPAC3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine
SMILESCc1ccc2c(c1)Sc1cc(OCCF)ccc1N2
InChIInChI=1S/C15H14FNOS/c1-10-2-4-12-14(8-10)19-15-9-11(18-7-6-16)3-5-13(15)17-12/h2-5,8-9,17H,6-7H2,1H3
InChIKeyLVPSSSLHGATSJN-UHFFFAOYSA-N
MW275.35 g/mol
LogP4.55
Rot. Bonds3

About 3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine

3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine (PubChem CID 162139870) has the molecular formula C15H14FNOS and a molecular weight of 275.35 g/mol. Its IUPAC name is 3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine.

Molecular Properties

Compound Name3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine
PubChem CID162139870
Molecular FormulaC15H14FNOS
Molecular Weight275.35 g/mol
Exact Mass275.08
IUPAC Name3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine
SMILESCc1ccc2c(c1)Sc1cc(OCCF)ccc1N2
InChIInChI=1S/C15H14FNOS/c1-10-2-4-12-14(8-10)19-15-9-11(18-7-6-16)3-5-13(15)17-12/h2-5,8-9,17H,6-7H2,1H3
InChIKeyLVPSSSLHGATSJN-UHFFFAOYSA-N
XLogP4.55
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-7-prop-2-ynoxy-10H-phenothiazine
CID 162139868
ethane;1-(2-fluoroethoxy)-4-methylbenzene
CID 142309231
5-methyl-2-[2-(10H-phenothiazin-3-yloxy)ethyl]-1H-pyrazol-3-one
CID 91935014
2,4-bis(2-fluoroethoxy)-1-methylbenzene
CID 15058706
3-(7-methylthianthren-2-yl)-10H-phenothiazine
CID 175624592
2-methyl-10H-phenothiazine
CID 611628
1,3,5-tris(2-fluoroethoxy)benzene
CID 22164154
7-fluoro-2-methoxy-10H-phenothiazine
CID 13153678
8-ethyl-3-methoxy-12H-benzo[b]phenothiazine
CID 139221802
7-octoxy-4H-1,4-benzothiazin-3-one
CID 45257676
2-butoxy-6-methylnaphthalene
CID 58718847
4-(2-fluoroethoxy)-2-methylbenzenesulfonamide
CID 80694123

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine?
The IUPAC name of 3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine (CID 162139870) is 3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine.
What is the SMILES notation for 3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine?
The canonical SMILES for 3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine is Cc1ccc2c(c1)Sc1cc(OCCF)ccc1N2.
What is the InChIKey of 3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine?
The InChIKey is LVPSSSLHGATSJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNOS/c1-10-2-4-12-14(8-10)19-15-9-11(18-7-6-16)3-5-13(15)17-12/h2-5,8-9,17H,6-7H2,1H3.
What are the key properties of 3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine?
3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine has a molecular weight of 275.35 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoroethoxy)-7-methyl-10H-phenothiazine is sourced from PubChem (CID 162139870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).