N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide

C21H19N5O2S — CID 58056195

IUPACN-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
SMILESO=C(Nc1cc2cccnc2cc1OC1CCNCC1)c1csc2cncnc12
InChIInChI=1S/C21H19N5O2S/c27-21(15-11-29-19-10-23-12-25-20(15)19)26-17-8-13-2-1-5-24-16(13)9-18(17)28-14-3-6-22-7-4-14/h1-2,5,8-12,14,22H,3-4,6-7H2,(H,26,27)
InChIKeyQGAUJXAPAPNGCX-UHFFFAOYSA-N
MW405.48 g/mol
LogP3.62
Rot. Bonds4

About N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide

N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide (PubChem CID 58056195) has the molecular formula C21H19N5O2S and a molecular weight of 405.48 g/mol. Its IUPAC name is N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide.

Molecular Properties

Compound NameN-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
PubChem CID58056195
Molecular FormulaC21H19N5O2S
Molecular Weight405.48 g/mol
Exact Mass405.13
IUPAC NameN-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
SMILESO=C(Nc1cc2cccnc2cc1OC1CCNCC1)c1csc2cncnc12
InChIInChI=1S/C21H19N5O2S/c27-21(15-11-29-19-10-23-12-25-20(15)19)26-17-8-13-2-1-5-24-16(13)9-18(17)28-14-3-6-22-7-4-14/h1-2,5,8-12,14,22H,3-4,6-7H2,(H,26,27)
InChIKeyQGAUJXAPAPNGCX-UHFFFAOYSA-N
XLogP3.62
TPSA89.03 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.48
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2-aminoethyl)(methyl)amino]-N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056092
6,6-dimethyl-2-(6-(pyrimidin-2-yl)-2,3-dihydrobenzo[b][1,4]oxazin-4-yl)-6,7-dihydrothiazolo[5,4-c]pyridin-4(5H)-one
CID 44577641
N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056356
7-[2-[4-(4-ethylpiperazin-1-yl)-2-methoxyanilino]thieno[3,2-d]pyrimidin-4-yl]oxy-1H-quinolin-2-one
CID 162670671
7-[2-[2-methoxy-4-(4-methylpiperazin-1-yl)anilino]thieno[3,2-d]pyrimidin-4-yl]oxy-1H-quinolin-2-one
CID 162676665
N-[2-[4-(4-bromo-2-fluoroanilino)-6-(prop-2-enoylamino)quinazolin-7-yl]oxyethyl]thiophene-2-carboxamide
CID 16678344
6-Hydroxymethyl-thieno[3,2-b]pyridine-3-carboxylic acid (7-methoxy-quinolin-6-yl)-amide
CID 56646548
2-(3-aminopropylamino)-N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056089
2-(cyclopropylamino)-N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056090
2-(2-aminoethylamino)-N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056111
2-(2-hydroxyethylamino)-N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056114
2-[2-hydroxyethyl(methyl)amino]-N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056119

Frequently Asked Questions

What is the IUPAC name of N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide?
The IUPAC name of N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide (CID 58056195) is N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide.
What is the SMILES notation for N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide?
The canonical SMILES for N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide is O=C(Nc1cc2cccnc2cc1OC1CCNCC1)c1csc2cncnc12.
What is the InChIKey of N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide?
The InChIKey is QGAUJXAPAPNGCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2S/c27-21(15-11-29-19-10-23-12-25-20(15)19)26-17-8-13-2-1-5-24-16(13)9-18(17)28-14-3-6-22-7-4-14/h1-2,5,8-12,14,22H,3-4,6-7H2,(H,26,27).
What are the key properties of N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide?
N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide has a molecular weight of 405.48 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-piperidin-4-yloxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide is sourced from PubChem (CID 58056195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).