6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione

C14H26N5O2+ — CID 7999822

IUPAC6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione
SMILESCn1c(N)c(NC2CC(C)(C)[NH2+]C(C)(C)C2)c(=O)[nH]c1=O
InChIInChI=1S/C14H25N5O2/c1-13(2)6-8(7-14(3,4)18-13)16-9-10(15)19(5)12(21)17-11(9)20/h8,16,18H,6-7,15H2,1-5H3,(H,17,20,21)/p+1
InChIKeyPCEFFEWSMULXHA-UHFFFAOYSA-O
MW296.40 g/mol
LogP-0.65
Rot. Bonds2

About 6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione

6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione (PubChem CID 7999822) has the molecular formula C14H26N5O2+ and a molecular weight of 296.40 g/mol. Its IUPAC name is 6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione
PubChem CID7999822
Molecular FormulaC14H26N5O2+
Molecular Weight296.40 g/mol
Exact Mass296.21
IUPAC Name6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione
SMILESCn1c(N)c(NC2CC(C)(C)[NH2+]C(C)(C)C2)c(=O)[nH]c1=O
InChIInChI=1S/C14H25N5O2/c1-13(2)6-8(7-14(3,4)18-13)16-9-10(15)19(5)12(21)17-11(9)20/h8,16,18H,6-7,15H2,1-5H3,(H,17,20,21)/p+1
InChIKeyPCEFFEWSMULXHA-UHFFFAOYSA-O
XLogP-0.65
TPSA109.52 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.40
LogP ≤ 5-0.65
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze 6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione 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

6-Amino-1-methyl-5-((2,2,6,6-tetramethylpiperidin-4-yl)amino)pyrimidine-2,4(1H,3H)-dione
CID 4846739
5-(4,4-dimethyl-2-propylpiperidin-1-yl)-1H-pyrimidine-2,4-dione
CID 3154244
6-Amino-5-(6-methylheptan-2-ylamino)-1-propylpyrimidine-2,4-dione
CID 4878520
1-(6-Amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-cyclohexyl-1-ethylurea
CID 9516657
1-(6-Amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-cyclohexyl-1-(3-methylbutyl)urea
CID 9535396
5,6-Diamino-1-(4-piperidinyl)-2,4(1h,3h)-pyrimidinedione
CID 21958609
6-amino-1-methyl-5-{[(trans-4-methylcyclohexyl)methyl]amino}pyrimidine-2,4(1H,3H)-dione
CID 55139426
6-Amino-5-(cyclohexylmethylamino)-1-methylpyrimidine-2,4-dione
CID 60649220
6-amino-1-methyl-5-((1-((trans)-4-methylcyclohexyl)ethyl)amino)pyrimidine-2,4(1H,3H)-dione
CID 118558977
6-Amino-3-[5-amino-6-(cyclohexylmethylamino)hexyl]-1-methyl-5-(methylamino)pyrimidine-2,4-dione
CID 141817357
5,6-Diamino-3-(4-piperidinyl)-2,4(1h,3h)-pyrimidinedione
CID 153878001
5-[(2S)-4,4-dimethyl-2-propylpiperidin-1-yl]-1H-pyrimidine-2,4-dione
CID 1085047

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione?
The IUPAC name of 6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione (CID 7999822) is 6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione is Cn1c(N)c(NC2CC(C)(C)[NH2+]C(C)(C)C2)c(=O)[nH]c1=O.
What is the InChIKey of 6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione?
The InChIKey is PCEFFEWSMULXHA-UHFFFAOYSA-O. The full InChI is InChI=1S/C14H25N5O2/c1-13(2)6-8(7-14(3,4)18-13)16-9-10(15)19(5)12(21)17-11(9)20/h8,16,18H,6-7,15H2,1-5H3,(H,17,20,21)/p+1.
What are the key properties of 6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione?
6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione has a molecular weight of 296.40 g/mol, XLogP of -0.65, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-methyl-5-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]pyrimidine-2,4-dione is sourced from PubChem (CID 7999822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).