N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide

C16H17N3O2S — CID 14881592

IUPACN-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide
SMILESCOc1cccc(NC(=O)C2CSC(c3cccnc3)N2)c1
InChIInChI=1S/C16H17N3O2S/c1-21-13-6-2-5-12(8-13)18-15(20)14-10-22-16(19-14)11-4-3-7-17-9-11/h2-9,14,16,19H,10H2,1H3,(H,18,20)
InChIKeyWHWZRZHGCYWNIC-UHFFFAOYSA-N
MW315.40 g/mol
LogP2.43
Rot. Bonds4

About N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide

N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide (PubChem CID 14881592) has the molecular formula C16H17N3O2S and a molecular weight of 315.40 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide
PubChem CID14881592
Molecular FormulaC16H17N3O2S
Molecular Weight315.40 g/mol
Exact Mass315.10
IUPAC NameN-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide
SMILESCOc1cccc(NC(=O)C2CSC(c3cccnc3)N2)c1
InChIInChI=1S/C16H17N3O2S/c1-21-13-6-2-5-12(8-13)18-15(20)14-10-22-16(19-14)11-4-3-7-17-9-11/h2-9,14,16,19H,10H2,1H3,(H,18,20)
InChIKeyWHWZRZHGCYWNIC-UHFFFAOYSA-N
XLogP2.43
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.40
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(4R)-N-(3-chlorophenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide
CID 10313907
N-phenyl-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 14881601
2-pyridin-3-yl-N-[3-(3,4,5-trimethoxybenzoyl)phenyl]-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 19894108
N-(3-benzoylphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 67898557
1-N-(3-methoxyphenyl)-2-N-(pyridin-3-ylmethyl)cyclopropane-1,2-dicarboxamide
CID 109137105
methyl (2S)-4-methyl-2-[(2-pyridin-3-yl-1,3-thiazolidine-4-carbonyl)amino]pentanoate
CID 14881578
2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 19894077
N-(3-butoxypropyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide
CID 14881673
(1S,2R,3S,4R)-3-N-(3-methoxyphenyl)-2-N-(pyridin-3-ylmethyl)-7-oxabicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide
CID 11878650
4-hydroxy-N-(3-methoxyphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119670498
(2R)-N-(3-methoxyphenyl)azepane-2-carboxamide
CID 124509646
N-(3-methoxyphenyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide
CID 66470767

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide (CID 14881592) is N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide is COc1cccc(NC(=O)C2CSC(c3cccnc3)N2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide?
The InChIKey is WHWZRZHGCYWNIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2S/c1-21-13-6-2-5-12(8-13)18-15(20)14-10-22-16(19-14)11-4-3-7-17-9-11/h2-9,14,16,19H,10H2,1H3,(H,18,20).
What are the key properties of N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide?
N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide has a molecular weight of 315.40 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 14881592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).