N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide

C17H18N6O2S — CID 155230455

IUPACN-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide
SMILESCNC(=O)c1cccnc1Nc1nc(-c2ccc(OC(C)C)cn2)ns1
InChIInChI=1S/C17H18N6O2S/c1-10(2)25-11-6-7-13(20-9-11)15-22-17(26-23-15)21-14-12(16(24)18-3)5-4-8-19-14/h4-10H,1-3H3,(H,18,24)(H,19,21,22,23)
InChIKeyBBSQBANUAANAMF-UHFFFAOYSA-N
MW370.44 g/mol
LogP2.89
Rot. Bonds6

About N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide

N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide (PubChem CID 155230455) has the molecular formula C17H18N6O2S and a molecular weight of 370.44 g/mol. Its IUPAC name is N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide
PubChem CID155230455
Molecular FormulaC17H18N6O2S
Molecular Weight370.44 g/mol
Exact Mass370.12
IUPAC NameN-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide
SMILESCNC(=O)c1cccnc1Nc1nc(-c2ccc(OC(C)C)cn2)ns1
InChIInChI=1S/C17H18N6O2S/c1-10(2)25-11-6-7-13(20-9-11)15-22-17(26-23-15)21-14-12(16(24)18-3)5-4-8-19-14/h4-10H,1-3H3,(H,18,24)(H,19,21,22,23)
InChIKeyBBSQBANUAANAMF-UHFFFAOYSA-N
XLogP2.89
TPSA101.92 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.44
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide with MolForge

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Related Compounds

Triazine-4-carboxamide, 13
CID 44520938
4-amino-6-(2-fluoroethoxy)-2-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-5-carboxamide
CID 142609098
4-amino-2-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-5-carboxamide
CID 142609112
3-[5-(1-cyclopropyl-3,3-difluoropiperidin-4-yl)oxypyridin-2-yl]-N-(3-methylpyridin-2-yl)-1,2,4-thiadiazol-5-amine
CID 155230143
3-N,3-N-dimethyl-2-N-[3-[5-propan-2-yloxy-4-(trifluoromethyl)pyridin-2-yl]-1,2,4-thiadiazol-5-yl]pyridine-2,3-diamine
CID 155230212
N-(3-methoxy-2-pyridinyl)-3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-amine
CID 155230217
N-(3-methyl-2-pyridinyl)-3-[5-(oxan-4-yloxy)-2-pyridinyl]-1,2,4-thiadiazol-5-amine
CID 155230223
3-N-methyl-2-N-[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]pyridine-2,3-diamine
CID 155230270
2-N-[3-(5-cyclopropyloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]-3-N,3-N-dimethylpyridine-2,3-diamine
CID 155230363
N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide
CID 155230370
N,N-dimethyl-2-[5-[(3-methyl-2-pyridinyl)amino]-1,2,4-thiadiazol-3-yl]-5-propan-2-yloxypyridine-4-carboxamide
CID 155230435
3-[5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]-2-pyridinyl]-N-(3-methyl-2-pyridinyl)-1,2,4-thiadiazol-5-amine
CID 155230437

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide?
The IUPAC name of N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide (CID 155230455) is N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide?
The canonical SMILES for N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide is CNC(=O)c1cccnc1Nc1nc(-c2ccc(OC(C)C)cn2)ns1.
What is the InChIKey of N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide?
The InChIKey is BBSQBANUAANAMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N6O2S/c1-10(2)25-11-6-7-13(20-9-11)15-22-17(26-23-15)21-14-12(16(24)18-3)5-4-8-19-14/h4-10H,1-3H3,(H,18,24)(H,19,21,22,23).
What are the key properties of N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide?
N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide has a molecular weight of 370.44 g/mol, XLogP of 2.89, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 155230455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).