N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide

C19H20N4OS — CID 172898892

IUPACN-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide
SMILESCc1csc2c(N3CCC(NC(=O)c4ccccc4)CC3)ncnc12
InChIInChI=1S/C19H20N4OS/c1-13-11-25-17-16(13)20-12-21-18(17)23-9-7-15(8-10-23)22-19(24)14-5-3-2-4-6-14/h2-6,11-12,15H,7-10H2,1H3,(H,22,24)
InChIKeyKJRRKDQWCRRRNV-UHFFFAOYSA-N
MW352.46 g/mol
LogP3.40
Rot. Bonds3

About N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide

N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide (PubChem CID 172898892) has the molecular formula C19H20N4OS and a molecular weight of 352.46 g/mol. Its IUPAC name is N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide.

Molecular Properties

Compound NameN-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide
PubChem CID172898892
Molecular FormulaC19H20N4OS
Molecular Weight352.46 g/mol
Exact Mass352.14
IUPAC NameN-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide
SMILESCc1csc2c(N3CCC(NC(=O)c4ccccc4)CC3)ncnc12
InChIInChI=1S/C19H20N4OS/c1-13-11-25-17-16(13)20-12-21-18(17)23-9-7-15(8-10-23)22-19(24)14-5-3-2-4-6-14/h2-6,11-12,15H,7-10H2,1H3,(H,22,24)
InChIKeyKJRRKDQWCRRRNV-UHFFFAOYSA-N
XLogP3.40
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-methylphenyl)-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]propanamide
CID 156555013
N-cyclopentyl-2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]acetamide
CID 171994481
1-(7-methylthieno[3,2-d]pyrimidin-4-yl)-N-[(E)-3-phenylprop-2-enyl]piperidin-4-amine
CID 156539132
1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-ol
CID 102687010
N,N-dimethyl-1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide
CID 171691257
N-[1-(1-methylpyrazolo[4,5-d]pyrimidin-7-yl)piperidin-4-yl]benzamide
CID 172898890
N-[2-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]-1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-amine
CID 72931211
1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidine-3-carboxylic acid
CID 102685906
1,5-dimethyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-3-yl]pyrazole-3-carboxamide
CID 172903005
N-(5-chloro-2-pyridinyl)-1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide
CID 126794223
1-(7-methylthieno[3,2-d]pyrimidin-4-yl)-N-(oxan-4-yl)piperidine-3-carboxamide
CID 166604692
N-[3-(3-chlorophenyl)propyl]-1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-amine
CID 156555049

Frequently Asked Questions

What is the IUPAC name of N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide?
The IUPAC name of N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide (CID 172898892) is N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide.
What is the SMILES notation for N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide?
The canonical SMILES for N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide is Cc1csc2c(N3CCC(NC(=O)c4ccccc4)CC3)ncnc12.
What is the InChIKey of N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide?
The InChIKey is KJRRKDQWCRRRNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4OS/c1-13-11-25-17-16(13)20-12-21-18(17)23-9-7-15(8-10-23)22-19(24)14-5-3-2-4-6-14/h2-6,11-12,15H,7-10H2,1H3,(H,22,24).
What are the key properties of N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide?
N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide has a molecular weight of 352.46 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide is sourced from PubChem (CID 172898892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).