N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide

C19H26N4O2S — CID 46959387

IUPACN-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide
SMILESCc1sc2nc(C)n(C3CCN(CC(=O)NC4CC4)CC3)c(=O)c2c1C
InChIInChI=1S/C19H26N4O2S/c1-11-12(2)26-18-17(11)19(25)23(13(3)20-18)15-6-8-22(9-7-15)10-16(24)21-14-4-5-14/h14-15H,4-10H2,1-3H3,(H,21,24)
InChIKeyNMQBFCLOOWWWJE-UHFFFAOYSA-N
MW374.51 g/mol
LogP2.30
Rot. Bonds4

About N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide

N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide (PubChem CID 46959387) has the molecular formula C19H26N4O2S and a molecular weight of 374.51 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide
PubChem CID46959387
Molecular FormulaC19H26N4O2S
Molecular Weight374.51 g/mol
Exact Mass374.18
IUPAC NameN-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide
SMILESCc1sc2nc(C)n(C3CCN(CC(=O)NC4CC4)CC3)c(=O)c2c1C
InChIInChI=1S/C19H26N4O2S/c1-11-12(2)26-18-17(11)19(25)23(13(3)20-18)15-6-8-22(9-7-15)10-16(24)21-14-4-5-14/h14-15H,4-10H2,1-3H3,(H,21,24)
InChIKeyNMQBFCLOOWWWJE-UHFFFAOYSA-N
XLogP2.30
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide 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

2,5,6-trimethyl-3-[1-(pyridin-4-ylmethyl)piperidin-4-yl]thieno[2,3-d]pyrimidin-4-one
CID 46959379
2-[4-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]piperazin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 9116227
2-[4-(2-benzyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide
CID 16672546
2,5,6-trimethyl-3-[1-[(2S)-2-phenylpropanoyl]piperidin-4-yl]thieno[2,3-d]pyrimidin-4-one
CID 51494309
N-cyclopropyl-3-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide
CID 18150899
3-[2-(cyclopropylamino)-2-oxoethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylic acid
CID 45395953
3-cyclopropyl-2-[(2-hydroxyethylamino)methyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-one
CID 39147039
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 28528656
N-cyclopropyl-2-(5,6-dimethyl-2-propan-2-ylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide
CID 3218952
N-cyclohexyl-2-[3-(3-ethoxypropyl)-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide
CID 2639502
N-(cyclopropylcarbamoyl)-2-(5,6-dimethyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide
CID 7885859
2-cyclopropyl-5,6-dimethyl-3-[1-(2-thiophen-3-ylacetyl)piperidin-4-yl]thieno[2,3-d]pyrimidin-4-one
CID 46952417

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide (CID 46959387) is N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide is Cc1sc2nc(C)n(C3CCN(CC(=O)NC4CC4)CC3)c(=O)c2c1C.
What is the InChIKey of N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide?
The InChIKey is NMQBFCLOOWWWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2S/c1-11-12(2)26-18-17(11)19(25)23(13(3)20-18)15-6-8-22(9-7-15)10-16(24)21-14-4-5-14/h14-15H,4-10H2,1-3H3,(H,21,24).
What are the key properties of N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide?
N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide has a molecular weight of 374.51 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 46959387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).