(10-methylphenothiazin-3-yl)methanol

C14H13NOS — CID 638533

IUPAC(10-methylphenothiazin-3-yl)methanol
SMILESCN1c2ccccc2Sc2cc(CO)ccc21
InChIInChI=1S/C14H13NOS/c1-15-11-4-2-3-5-13(11)17-14-8-10(9-16)6-7-12(14)15/h2-8,16H,9H2,1H3
InChIKeyHDQFWPZZCXBWRH-UHFFFAOYSA-N
MW243.33 g/mol
LogP3.41
Rot. Bonds1

About (10-methylphenothiazin-3-yl)methanol

(10-methylphenothiazin-3-yl)methanol (PubChem CID 638533) has the molecular formula C14H13NOS and a molecular weight of 243.33 g/mol. Its IUPAC name is (10-methylphenothiazin-3-yl)methanol.

Molecular Properties

Compound Name(10-methylphenothiazin-3-yl)methanol
PubChem CID638533
Molecular FormulaC14H13NOS
Molecular Weight243.33 g/mol
Exact Mass243.07
IUPAC Name(10-methylphenothiazin-3-yl)methanol
SMILESCN1c2ccccc2Sc2cc(CO)ccc21
InChIInChI=1S/C14H13NOS/c1-15-11-4-2-3-5-13(11)17-14-8-10(9-16)6-7-12(14)15/h2-8,16H,9H2,1H3
InChIKeyHDQFWPZZCXBWRH-UHFFFAOYSA-N
XLogP3.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(10H-phenothiazin-2-yl)methanol
CID 67358482
4-methyl-2-phenyl-3H-1,4-benzothiazin-2-ol
CID 145951676
2-(10-Acetyl-10H-phenothiazin-3-yl)-1,1,1,3,3,3-hexafluoro-2-propanol
CID 293514
2H-1,4-Benzothiazine-2-methanol, 3,4-dihydro-4-ethyl-alpha-phenyl-, hydrochloride
CID 24835394
[10-[3-(Dimethylamino)propyl]phenothiazin-2-yl]methanol
CID 44286084
1,1,1,3,3,3-Hexafluoro-2-[4-[(4-fluorophenyl)methyl]-2,3-dihydro-1,4-benzothiazin-7-yl]propan-2-ol
CID 145976534
1-[10-[3-(Dimethylamino)propyl]phenothiazin-2-yl]ethanol
CID 525233
10-Methyl-10H-phenothiazine-3-carboxylic acid
CID 620873
(10-ethyl-10H-phenothiazin-4-yl)methanol
CID 638528
1-(10-Ethylphenothiazin-4-yl)-2,2-dimethylpropan-1-ol
CID 10495423
(N-hexylphenothiazine-3-yl)methanol
CID 44239570
[7-(trifluoromethyl)-10H-phenothiazin-3-yl]methanol
CID 123335517

Frequently Asked Questions

What is the IUPAC name of (10-methylphenothiazin-3-yl)methanol?
The IUPAC name of (10-methylphenothiazin-3-yl)methanol (CID 638533) is (10-methylphenothiazin-3-yl)methanol.
What is the SMILES notation for (10-methylphenothiazin-3-yl)methanol?
The canonical SMILES for (10-methylphenothiazin-3-yl)methanol is CN1c2ccccc2Sc2cc(CO)ccc21.
What is the InChIKey of (10-methylphenothiazin-3-yl)methanol?
The InChIKey is HDQFWPZZCXBWRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NOS/c1-15-11-4-2-3-5-13(11)17-14-8-10(9-16)6-7-12(14)15/h2-8,16H,9H2,1H3.
What are the key properties of (10-methylphenothiazin-3-yl)methanol?
(10-methylphenothiazin-3-yl)methanol has a molecular weight of 243.33 g/mol, XLogP of 3.41, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (10-methylphenothiazin-3-yl)methanol is sourced from PubChem (CID 638533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).