N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide

C15H15N3OS — CID 71551050

IUPACN-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide
SMILESCCCCc1nc2c(NC=O)nc3ccccc3c2s1
InChIInChI=1S/C15H15N3OS/c1-2-3-8-12-18-13-14(20-12)10-6-4-5-7-11(10)17-15(13)16-9-19/h4-7,9H,2-3,8H2,1H3,(H,16,17,19)
InChIKeyFZSSOOVDCOFBMW-UHFFFAOYSA-N
MW285.37 g/mol
LogP3.76
Rot. Bonds5

About N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide

N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide (PubChem CID 71551050) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide.

Molecular Properties

Compound NameN-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide
PubChem CID71551050
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC NameN-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide
SMILESCCCCc1nc2c(NC=O)nc3ccccc3c2s1
InChIInChI=1S/C15H15N3OS/c1-2-3-8-12-18-13-14(20-12)10-6-4-5-7-11(10)17-15(13)16-9-19/h4-7,9H,2-3,8H2,1H3,(H,16,17,19)
InChIKeyFZSSOOVDCOFBMW-UHFFFAOYSA-N
XLogP3.76
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)butanamide
CID 71551097
N-tert-butyl-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine
CID 168796205
4-methyl-N-(2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)benzenesulfonamide
CID 71551048
4-chloro-2-propyl-[1,3]thiazolo[4,5-c]quinoline
CID 71551696
2-(4-amino-[1,3]thiazolo[4,5-c]quinolin-2-yl)acetaldehyde
CID 59497158
N'-[2-[4-(2,5-dioxopyrrol-1-yl)butanoyl-methylamino]ethyl]-N'-methyl-N-(2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)butanediamide
CID 59372572
2-butyl-7-fluoro-1,3-benzothiazole
CID 175941310
9-butylacridine
CID 606127
2-pentyl-1,3-benzothiazole-7-carboxylic acid
CID 138602299
2,2,2-trichloro-N-(7-methyl-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)acetamide
CID 22648319
ethyl 3-amino-4-(butylamino)thieno[3,2-c]quinoline-2-carboxylate
CID 11163711
(3-butylquinoxalin-2-yl)hydrazine
CID 119088343

Frequently Asked Questions

What is the IUPAC name of N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide?
The IUPAC name of N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide (CID 71551050) is N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide.
What is the SMILES notation for N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide?
The canonical SMILES for N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide is CCCCc1nc2c(NC=O)nc3ccccc3c2s1.
What is the InChIKey of N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide?
The InChIKey is FZSSOOVDCOFBMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-2-3-8-12-18-13-14(20-12)10-6-4-5-7-11(10)17-15(13)16-9-19/h4-7,9H,2-3,8H2,1H3,(H,16,17,19).
What are the key properties of N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide?
N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide has a molecular weight of 285.37 g/mol, XLogP of 3.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-butyl-[1,3]thiazolo[4,5-c]quinolin-4-yl)formamide is sourced from PubChem (CID 71551050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).