N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride

C15H17Cl2N3OS — CID 14881601

IUPACN-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride
SMILESCl.Cl.O=C(Nc1ccccc1)C1CSC(c2cccnc2)N1
InChIInChI=1S/C15H15N3OS.2ClH/c19-14(17-12-6-2-1-3-7-12)13-10-20-15(18-13)11-5-4-8-16-9-11;;/h1-9,13,15,18H,10H2,(H,17,19);2*1H
InChIKeyDRQLZWBIMSHWAS-UHFFFAOYSA-N
MW358.29 g/mol
LogP3.27
Rot. Bonds3

About N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride

N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride (PubChem CID 14881601) has the molecular formula C15H17Cl2N3OS and a molecular weight of 358.29 g/mol. Its IUPAC name is N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride
PubChem CID14881601
Molecular FormulaC15H17Cl2N3OS
Molecular Weight358.29 g/mol
Exact Mass357.05
IUPAC NameN-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride
SMILESCl.Cl.O=C(Nc1ccccc1)C1CSC(c2cccnc2)N1
InChIInChI=1S/C15H15N3OS.2ClH/c19-14(17-12-6-2-1-3-7-12)13-10-20-15(18-13)11-5-4-8-16-9-11;;/h1-9,13,15,18H,10H2,(H,17,19);2*1H
InChIKeyDRQLZWBIMSHWAS-UHFFFAOYSA-N
XLogP3.27
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.29
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-benzoylphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 67898557
(4R)-N-(3-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide
CID 10313907
N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide
CID 14881592
2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 19894077
2-pyridin-3-yl-N-[3-(3,4,5-trimethoxybenzoyl)phenyl]-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 19894108
2-phenyl-1,3-thiazolidine-4-carbohydrazide
CID 3064949
N-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide
CID 67902424
N-(3-butoxypropyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide
CID 14881673
methyl (2S)-4-methyl-2-[(2-pyridin-3-yl-1,3-thiazolidine-4-carbonyl)amino]pentanoate
CID 14881578
2-[3-[(4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carbonyl]indol-1-yl]acetic acid;dihydrochloride
CID 45260555
(2,5-dimethyl-1H-indol-3-yl)-[(4R)-2-pyridin-3-yl-1,3-thiazolidin-4-yl]methanone
CID 10246465
(2,5-dimethyl-1H-indol-3-yl)-(2-pyridin-3-yl-1,3-thiazolidin-4-yl)methanone
CID 57113167

Frequently Asked Questions

What is the IUPAC name of N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride?
The IUPAC name of N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride (CID 14881601) is N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride.
What is the SMILES notation for N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride?
The canonical SMILES for N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride is Cl.Cl.O=C(Nc1ccccc1)C1CSC(c2cccnc2)N1.
What is the InChIKey of N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride?
The InChIKey is DRQLZWBIMSHWAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS.2ClH/c19-14(17-12-6-2-1-3-7-12)13-10-20-15(18-13)11-5-4-8-16-9-11;;/h1-9,13,15,18H,10H2,(H,17,19);2*1H.
What are the key properties of N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride?
N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride has a molecular weight of 358.29 g/mol, XLogP of 3.27, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride is sourced from PubChem (CID 14881601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).