6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione

C9H16N4O2 — CID 170890934

IUPAC6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione
SMILESCC(N)Cc1c(N)n(C)c(=O)n(C)c1=O
InChIInChI=1S/C9H16N4O2/c1-5(10)4-6-7(11)12(2)9(15)13(3)8(6)14/h5H,4,10-11H2,1-3H3
InChIKeyZHYQPOKCIXQPHF-UHFFFAOYSA-N
MW212.25 g/mol
LogP-1.44
Rot. Bonds2

About 6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione

6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione (PubChem CID 170890934) has the molecular formula C9H16N4O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione
PubChem CID170890934
Molecular FormulaC9H16N4O2
Molecular Weight212.25 g/mol
Exact Mass212.13
IUPAC Name6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione
SMILESCC(N)Cc1c(N)n(C)c(=O)n(C)c1=O
InChIInChI=1S/C9H16N4O2/c1-5(10)4-6-7(11)12(2)9(15)13(3)8(6)14/h5H,4,10-11H2,1-3H3
InChIKeyZHYQPOKCIXQPHF-UHFFFAOYSA-N
XLogP-1.44
TPSA96.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-1.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-amino-5-(azepan-1-ylmethyl)-1,3-dimethylpyrimidine-2,4-dione
CID 39100598
5,6-diamino-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione
CID 4110339
tert-butyl N-[3-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-2-oxopropyl]carbamate
CID 158183140
6-amino-5-(2-amino-1-phenylethyl)-1,3-dimethylpyrimidine-2,4-dione
CID 45496500
5-(hydroxymethyl)-1,3,6-trimethylpyrimidine-2,4-dione
CID 4153777
1-[4-(2-aminopropyl)-2,3,5,6-tetrachlorophenyl]propan-2-amine
CID 170864520
6-(1-aminopropan-2-yl)-1,3,5-trimethylpyrimidine-2,4-dione
CID 83856883
3-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-3-oxopropanenitrile
CID 2363689
6-amino-5-(2-amino-1,3-thiazol-4-yl)-1,3-dimethylpyrimidine-2,4-dione
CID 25469654
6-amino-5-[ethenyl(2-oxopropyl)amino]-1,3-dimethylpyrimidine-2,4-dione
CID 143494018
[2-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)propanoate
CID 4033338
5-(1,3-dimethyl-4-oxido-2,6-dioxopyrimidin-5-yl)-1,3-dimethyl-2,6-dioxopyrimidin-4-olate;methylazanium
CID 139175817

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione?
The IUPAC name of 6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione (CID 170890934) is 6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione?
The canonical SMILES for 6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione is CC(N)Cc1c(N)n(C)c(=O)n(C)c1=O.
What is the InChIKey of 6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione?
The InChIKey is ZHYQPOKCIXQPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2/c1-5(10)4-6-7(11)12(2)9(15)13(3)8(6)14/h5H,4,10-11H2,1-3H3.
What are the key properties of 6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione?
6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione has a molecular weight of 212.25 g/mol, XLogP of -1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-(2-aminopropyl)-1,3-dimethylpyrimidine-2,4-dione is sourced from PubChem (CID 170890934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).