N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide

C15H19N5OS — CID 119530984

IUPACN-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
SMILESCCCN(C(=O)c1csc(-c2cnccn2)n1)C1CCNC1
InChIInChI=1S/C15H19N5OS/c1-2-7-20(11-3-4-16-8-11)15(21)13-10-22-14(19-13)12-9-17-5-6-18-12/h5-6,9-11,16H,2-4,7-8H2,1H3
InChIKeyLGJVSEGBIIJFES-UHFFFAOYSA-N
MW317.42 g/mol
LogP1.81
Rot. Bonds5

About N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide

N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide (PubChem CID 119530984) has the molecular formula C15H19N5OS and a molecular weight of 317.42 g/mol. Its IUPAC name is N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
PubChem CID119530984
Molecular FormulaC15H19N5OS
Molecular Weight317.42 g/mol
Exact Mass317.13
IUPAC NameN-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
SMILESCCCN(C(=O)c1csc(-c2cnccn2)n1)C1CCNC1
InChIInChI=1S/C15H19N5OS/c1-2-7-20(11-3-4-16-8-11)15(21)13-10-22-14(19-13)12-9-17-5-6-18-12/h5-6,9-11,16H,2-4,7-8H2,1H3
InChIKeyLGJVSEGBIIJFES-UHFFFAOYSA-N
XLogP1.81
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.42
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-piperidin-4-yl-N-propyl-2-pyridin-4-yl-1,3-thiazole-4-carboxamide
CID 166298535
N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide
CID 103806535
4-methyl-N-propyl-2-pyrimidin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide;hydrochloride
CID 119533114
N-propyl-5-pyridin-3-yl-N-pyrrolidin-3-yl-1,2-oxazole-3-carboxamide;dihydrochloride
CID 119532386
N-ethyl-2-(2-phenyltriazol-4-yl)-N-[(3S)-pyrrolidin-3-yl]-1,3-thiazole-4-carboxamide
CID 168890470
2-(3-chlorophenyl)-N-piperidin-4-yl-N-propyl-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119824421
N-piperidin-3-yl-N-propylpyridine-3-carboxamide
CID 63638133
5-bromo-N-propyl-N-pyrrolidin-3-ylpyridine-2-carboxamide;dihydrochloride
CID 119531290
4-phenoxy-N-propyl-N-pyrrolidin-3-ylpyridine-2-carboxamide
CID 119531895
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-piperidin-4-yl-N-propyl-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119824275
N,2-dipropyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide
CID 119533233
N-propyl-N-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide
CID 115737122

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide (CID 119530984) is N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide is CCCN(C(=O)c1csc(-c2cnccn2)n1)C1CCNC1.
What is the InChIKey of N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide?
The InChIKey is LGJVSEGBIIJFES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5OS/c1-2-7-20(11-3-4-16-8-11)15(21)13-10-22-14(19-13)12-9-17-5-6-18-12/h5-6,9-11,16H,2-4,7-8H2,1H3.
What are the key properties of N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide?
N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide has a molecular weight of 317.42 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-pyrazin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 119530984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).