6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione

C16H20N6O2 — CID 172572669

IUPAC6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione
SMILESCCNc1cc(Nc2cc(C)c3n(c2=O)C(C)(C)NC3=O)ncn1
InChIInChI=1S/C16H20N6O2/c1-5-17-11-7-12(19-8-18-11)20-10-6-9(2)13-14(23)21-16(3,4)22(13)15(10)24/h6-8H,5H2,1-4H3,(H,21,23)(H2,17,18,19,20)
InChIKeyJCXJDEGFLPEIQJ-UHFFFAOYSA-N
MW328.38 g/mol
LogP1.56
Rot. Bonds4

About 6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione

6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione (PubChem CID 172572669) has the molecular formula C16H20N6O2 and a molecular weight of 328.38 g/mol. Its IUPAC name is 6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione.

Molecular Properties

Compound Name6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione
PubChem CID172572669
Molecular FormulaC16H20N6O2
Molecular Weight328.38 g/mol
Exact Mass328.16
IUPAC Name6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione
SMILESCCNc1cc(Nc2cc(C)c3n(c2=O)C(C)(C)NC3=O)ncn1
InChIInChI=1S/C16H20N6O2/c1-5-17-11-7-12(19-8-18-11)20-10-6-9(2)13-14(23)21-16(3,4)22(13)15(10)24/h6-8H,5H2,1-4H3,(H,21,23)(H2,17,18,19,20)
InChIKeyJCXJDEGFLPEIQJ-UHFFFAOYSA-N
XLogP1.56
TPSA100.94 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 51.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione with MolForge

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Related Compounds

6-[[6-(ethylamino)pyrimidin-4-yl]amino]-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-1,5-dione
CID 172572670
3,3,8-trimethyl-6-(pyrimidin-4-ylamino)-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 160750705
6-[(4-amino-1,3,5-triazin-2-yl)amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione;molecular hydrogen
CID 158478502
6-[[6-(2-hydroxyethylamino)pyrimidin-4-yl]amino]-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,4'-oxane]-1,5-dione
CID 162431069
N-[6-[[(1E)-1-ethylidene-8-methyl-5-oxospiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclopentane]-6-yl]amino]pyrimidin-4-yl]-2-methylpropanamide;6-[[6-(2-hydroxyethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 172572704
6-[(6-aminopyrimidin-4-yl)amino]-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,4'-piperidine]-1,5-dione
CID 118598796
6-[(6-aminopyrimidin-4-yl)amino]-8-methyl-1'-propylspiro[2H-imidazo[1,5-a]pyridine-3,7'-cycloheptene]-1,5-dione
CID 162740187
8-fluoro-3,3-dimethyl-6-(pyrimidin-4-ylamino)-2H-imidazo[1,5-a]pyridine-1,5-dione
CID 118599128
CID 166460731
CID 166460731
CID 167457384
CID 167457384
CID 167457399
CID 167457399
bis(6-[(6-aminopyrimidin-4-yl)amino]-8-chloro-3,3-dimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione);N-[6-[(8-chloro-3,3-dimethyl-1,5-dioxo-2H-imidazo[1,5-a]pyridin-6-yl)amino]pyrimidin-4-yl]cyclopropanecarboxamide
CID 157481702

Frequently Asked Questions

What is the IUPAC name of 6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione?
The IUPAC name of 6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione (CID 172572669) is 6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione.
What is the SMILES notation for 6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione?
The canonical SMILES for 6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione is CCNc1cc(Nc2cc(C)c3n(c2=O)C(C)(C)NC3=O)ncn1.
What is the InChIKey of 6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione?
The InChIKey is JCXJDEGFLPEIQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O2/c1-5-17-11-7-12(19-8-18-11)20-10-6-9(2)13-14(23)21-16(3,4)22(13)15(10)24/h6-8H,5H2,1-4H3,(H,21,23)(H2,17,18,19,20).
What are the key properties of 6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione?
6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione has a molecular weight of 328.38 g/mol, XLogP of 1.56, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[6-(ethylamino)pyrimidin-4-yl]amino]-3,3,8-trimethyl-2H-imidazo[1,5-a]pyridine-1,5-dione is sourced from PubChem (CID 172572669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).