N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride

C19H24ClN3OS — CID 3029940

IUPACN-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride
SMILESCCN(CC)CCNC(=O)N1c2ccccc2Sc2ccccc21.Cl
InChIInChI=1S/C19H23N3OS.ClH/c1-3-21(4-2)14-13-20-19(23)22-15-9-5-7-11-17(15)24-18-12-8-6-10-16(18)22;/h5-12H,3-4,13-14H2,1-2H3,(H,20,23);1H
InChIKeyNEJVTJBGMQAKIK-UHFFFAOYSA-N
MW377.94 g/mol
LogP4.76
Rot. Bonds5

About N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride

N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride (PubChem CID 3029940) has the molecular formula C19H24ClN3OS and a molecular weight of 377.94 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride
PubChem CID3029940
Molecular FormulaC19H24ClN3OS
Molecular Weight377.94 g/mol
Exact Mass377.13
IUPAC NameN-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride
SMILESCCN(CC)CCNC(=O)N1c2ccccc2Sc2ccccc21.Cl
InChIInChI=1S/C19H23N3OS.ClH/c1-3-21(4-2)14-13-20-19(23)22-15-9-5-7-11-17(15)24-18-12-8-6-10-16(18)22;/h5-12H,3-4,13-14H2,1-2H3,(H,20,23);1H
InChIKeyNEJVTJBGMQAKIK-UHFFFAOYSA-N
XLogP4.76
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.94
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Promethazine
CID 4927
Promethazine Hydrochloride
CID 6014
(+-)-Ethopropazine
CID 3290
Ethopropazine Hydrochloride
CID 122824
Fenethazine
CID 68223
Diethazine
CID 65535
Desmonomethylpromazine
CID 28315
2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone
CID 69500
N,N,N,alpha-Tetramethyl-10H-phenothiazine-10-ethanaminium
CID 6016
N-propan-2-ylphenothiazine-10-carboxamide
CID 704259
2-(Dimethylamino)-1-(10H-phenothiazin-10-yl)-1-propanone
CID 113918
N,N,beta-Trimethyl-10H-phenothiazine-10-ethanamine
CID 110669

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride?
The IUPAC name of N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride (CID 3029940) is N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride?
The canonical SMILES for N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride is CCN(CC)CCNC(=O)N1c2ccccc2Sc2ccccc21.Cl.
What is the InChIKey of N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride?
The InChIKey is NEJVTJBGMQAKIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3OS.ClH/c1-3-21(4-2)14-13-20-19(23)22-15-9-5-7-11-17(15)24-18-12-8-6-10-16(18)22;/h5-12H,3-4,13-14H2,1-2H3,(H,20,23);1H.
What are the key properties of N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride?
N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride has a molecular weight of 377.94 g/mol, XLogP of 4.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]phenothiazine-10-carboxamide;hydrochloride is sourced from PubChem (CID 3029940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).