N,N-diethyl-10H-phenothiazin-3-amine

C16H18N2S — CID 68755312

IUPACN,N-diethyl-10H-phenothiazin-3-amine
SMILESCCN(CC)c1ccc2c(c1)Sc1ccccc1N2
InChIInChI=1S/C16H18N2S/c1-3-18(4-2)12-9-10-14-16(11-12)19-15-8-6-5-7-13(15)17-14/h5-11,17H,3-4H2,1-2H3
InChIKeyHQDFRMZVMKJZLX-UHFFFAOYSA-N
MW270.40 g/mol
LogP4.74
Rot. Bonds3

About N,N-diethyl-10H-phenothiazin-3-amine

N,N-diethyl-10H-phenothiazin-3-amine (PubChem CID 68755312) has the molecular formula C16H18N2S and a molecular weight of 270.40 g/mol. Its IUPAC name is N,N-diethyl-10H-phenothiazin-3-amine.

Molecular Properties

Compound NameN,N-diethyl-10H-phenothiazin-3-amine
PubChem CID68755312
Molecular FormulaC16H18N2S
Molecular Weight270.40 g/mol
Exact Mass270.12
IUPAC NameN,N-diethyl-10H-phenothiazin-3-amine
SMILESCCN(CC)c1ccc2c(c1)Sc1ccccc1N2
InChIInChI=1S/C16H18N2S/c1-3-18(4-2)12-9-10-14-16(11-12)19-15-8-6-5-7-13(15)17-14/h5-11,17H,3-4H2,1-2H3
InChIKeyHQDFRMZVMKJZLX-UHFFFAOYSA-N
XLogP4.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.40
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dibutyl-10H-phenothiazin-3-amine
CID 68756798
2-benzyl-7-N,7-N-diethyl-10H-phenothiazine-3,7-diamine
CID 67403241
3-N,3-N,7-N,7-N-tetrabutyl-10H-phenothiazine-3,7-diamine
CID 21441331
ethane;10H-phenothiazine
CID 90730014
N-ethyl-10H-phenothiazin-3-amine
CID 163231038
(E)-3-[4-(diethylamino)phenyl]-1-(10H-phenothiazin-2-yl)prop-2-en-1-one
CID 19544437
copper;10H-phenothiazine;hydrochloride
CID 70634229
3-N,3-N,7-N,7-N-tetrakis(trideuteriomethyl)-10H-phenothiazine-3,7-diamine
CID 170996970
CID 69284773
CID 69284773
ethyl 10H-phenothiazine-3-carboxylate
CID 163320845
2-methyl-10H-phenothiazine
CID 611628
CID 174744500
CID 174744500

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-10H-phenothiazin-3-amine?
The IUPAC name of N,N-diethyl-10H-phenothiazin-3-amine (CID 68755312) is N,N-diethyl-10H-phenothiazin-3-amine.
What is the SMILES notation for N,N-diethyl-10H-phenothiazin-3-amine?
The canonical SMILES for N,N-diethyl-10H-phenothiazin-3-amine is CCN(CC)c1ccc2c(c1)Sc1ccccc1N2.
What is the InChIKey of N,N-diethyl-10H-phenothiazin-3-amine?
The InChIKey is HQDFRMZVMKJZLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2S/c1-3-18(4-2)12-9-10-14-16(11-12)19-15-8-6-5-7-13(15)17-14/h5-11,17H,3-4H2,1-2H3.
What are the key properties of N,N-diethyl-10H-phenothiazin-3-amine?
N,N-diethyl-10H-phenothiazin-3-amine has a molecular weight of 270.40 g/mol, XLogP of 4.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-10H-phenothiazin-3-amine is sourced from PubChem (CID 68755312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).