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

C18H25N5O2S — CID 172893051

IUPACN-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide
SMILESCc1csc2c(N3CCC(N(C)C(=O)N4CCOCC4)CC3)ncnc12
InChIInChI=1S/C18H25N5O2S/c1-13-11-26-16-15(13)19-12-20-17(16)22-5-3-14(4-6-22)21(2)18(24)23-7-9-25-10-8-23/h11-12,14H,3-10H2,1-2H3
InChIKeyOWNHOZXSZVFLJH-UHFFFAOYSA-N
MW375.50 g/mol
LogP2.35
Rot. Bonds2

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

N-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide (PubChem CID 172893051) has the molecular formula C18H25N5O2S and a molecular weight of 375.50 g/mol. Its IUPAC name is N-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide
PubChem CID172893051
Molecular FormulaC18H25N5O2S
Molecular Weight375.50 g/mol
Exact Mass375.17
IUPAC NameN-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide
SMILESCc1csc2c(N3CCC(N(C)C(=O)N4CCOCC4)CC3)ncnc12
InChIInChI=1S/C18H25N5O2S/c1-13-11-26-16-15(13)19-12-20-17(16)22-5-3-14(4-6-22)21(2)18(24)23-7-9-25-10-8-23/h11-12,14H,3-10H2,1-2H3
InChIKeyOWNHOZXSZVFLJH-UHFFFAOYSA-N
XLogP2.35
TPSA61.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.50
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N,N-dimethyl-1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide
CID 171691257
1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-ol
CID 102687010
1-(7-methylthieno[3,2-d]pyrimidin-4-yl)-N-(oxan-4-yl)piperidine-3-carboxamide
CID 166604692
[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)pyrrolidin-3-yl]-pyrrolidin-1-ylmethanone
CID 166602843
2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]oxyacetic acid
CID 102685980
N-methyl-N-[1-(4-methylphthalazin-1-yl)piperidin-4-yl]morpholine-4-carboxamide
CID 172893039
4-[(3R,4R)-4-methyl-1-(7-methylthieno[3,2-d]pyrimidin-4-yl)pyrrolidin-3-yl]morpholine
CID 124829142
1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidine-3-carboxylic acid
CID 102685906
N-cyclopentyl-2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]acetamide
CID 171994481
N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]benzamide
CID 172898892
4-ethyl-1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylic acid
CID 102685971
N-[1-(1,3-benzothiazol-2-yl)piperidin-4-yl]-N-methylmorpholine-4-carboxamide
CID 172881655

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide?
The IUPAC name of N-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide (CID 172893051) is N-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide.
What is the SMILES notation for N-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide?
The canonical SMILES for N-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide is Cc1csc2c(N3CCC(N(C)C(=O)N4CCOCC4)CC3)ncnc12.
What is the InChIKey of N-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide?
The InChIKey is OWNHOZXSZVFLJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O2S/c1-13-11-26-16-15(13)19-12-20-17(16)22-5-3-14(4-6-22)21(2)18(24)23-7-9-25-10-8-23/h11-12,14H,3-10H2,1-2H3.
What are the key properties of N-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide?
N-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide has a molecular weight of 375.50 g/mol, XLogP of 2.35, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]morpholine-4-carboxamide is sourced from PubChem (CID 172893051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).