6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione

C16H25N7O2 — CID 167997090

IUPAC6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione
SMILESCN1C(=O)CC(N2CCN(c3cc(N(C)C)ncn3)CC2)N(C)C1=O
InChIInChI=1S/C16H25N7O2/c1-19(2)12-9-13(18-11-17-12)22-5-7-23(8-6-22)14-10-15(24)21(4)16(25)20(14)3/h9,11,14H,5-8,10H2,1-4H3
InChIKeyGQEPWKCCYXQUCS-UHFFFAOYSA-N
MW347.42 g/mol
LogP-0.10
Rot. Bonds3

About 6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione

6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione (PubChem CID 167997090) has the molecular formula C16H25N7O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is 6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione.

Molecular Properties

Compound Name6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione
PubChem CID167997090
Molecular FormulaC16H25N7O2
Molecular Weight347.42 g/mol
Exact Mass347.21
IUPAC Name6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione
SMILESCN1C(=O)CC(N2CCN(c3cc(N(C)C)ncn3)CC2)N(C)C1=O
InChIInChI=1S/C16H25N7O2/c1-19(2)12-9-13(18-11-17-12)22-5-7-23(8-6-22)14-10-15(24)21(4)16(25)20(14)3/h9,11,14H,5-8,10H2,1-4H3
InChIKeyGQEPWKCCYXQUCS-UHFFFAOYSA-N
XLogP-0.10
TPSA76.12 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 5-0.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione with MolForge

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Related Compounds

6-[4-[6-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione
CID 167997103
6-[4-[2-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione
CID 167997093
6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethylpyrimidine-2,4-dione
CID 155942314
6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-N,N-dimethylpyridazin-3-amine
CID 155975901
6-[4-(2,5-dimethylphenyl)piperazin-1-yl]-N,N-dimethylpyrimidin-4-amine
CID 122282072
1-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-4-yl]-5-oxopyrrolidine-3-carboxamide
CID 126899571
2-[3-(dimethylamino)propyl]-9-[6-(dimethylamino)pyrimidin-4-yl]-2,9-diazaspiro[5.5]undecan-3-one
CID 72861684
7-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-3-propan-2-ylquinazolin-4-one
CID 126897381
6-[(9aS)-8-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl]-N-ethyl-N-methylpyrimidin-4-amine
CID 124824334
6-(3-aminopiperidin-1-yl)-N,N-dimethylpyrimidin-4-amine
CID 53185813
N,N-dimethyl-6-[4-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazin-1-yl]pyrimidin-4-amine
CID 155981005
N,N-dimethyl-6-[4-(4-piperidin-1-ylpyrimidin-2-yl)piperazin-1-yl]pyrimidin-4-amine
CID 171323717

Frequently Asked Questions

What is the IUPAC name of 6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione?
The IUPAC name of 6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione (CID 167997090) is 6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione.
What is the SMILES notation for 6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione?
The canonical SMILES for 6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione is CN1C(=O)CC(N2CCN(c3cc(N(C)C)ncn3)CC2)N(C)C1=O.
What is the InChIKey of 6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione?
The InChIKey is GQEPWKCCYXQUCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N7O2/c1-19(2)12-9-13(18-11-17-12)22-5-7-23(8-6-22)14-10-15(24)21(4)16(25)20(14)3/h9,11,14H,5-8,10H2,1-4H3.
What are the key properties of 6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione?
6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione has a molecular weight of 347.42 g/mol, XLogP of -0.10, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[6-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1,3-dimethyl-1,3-diazinane-2,4-dione is sourced from PubChem (CID 167997090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).