6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine

C13H23N5 — CID 80848372

IUPAC6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine
SMILESCNc1cc(NCC2C(C)(C)C2(C)C)nc(N)n1
InChIInChI=1S/C13H23N5/c1-12(2)8(13(12,3)4)7-16-10-6-9(15-5)17-11(14)18-10/h6,8H,7H2,1-5H3,(H4,14,15,16,17,18)
InChIKeyZNXUTOHBBNQMSB-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.19
Rot. Bonds4

About 6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine

6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine (PubChem CID 80848372) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine.

Molecular Properties

Compound Name6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine
PubChem CID80848372
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC Name6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine
SMILESCNc1cc(NCC2C(C)(C)C2(C)C)nc(N)n1
InChIInChI=1S/C13H23N5/c1-12(2)8(13(12,3)4)7-16-10-6-9(15-5)17-11(14)18-10/h6,8H,7H2,1-5H3,(H4,14,15,16,17,18)
InChIKeyZNXUTOHBBNQMSB-UHFFFAOYSA-N
XLogP2.19
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine with MolForge

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Related Compounds

6-chloro-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4-diamine
CID 80734968
4-N-ethyl-6-N-methylpyrimidine-2,4,6-triamine
CID 80769889
4-N-butyl-6-N-methylpyrimidine-2,4,6-triamine
CID 80784820
6-N-methyl-4-N-propylpyrimidine-2,4,6-triamine
CID 80766256
6-N-methyl-4-N-(2-methylpropyl)pyrimidine-2,4,6-triamine
CID 80770072
4-N-hexyl-6-N-methylpyrimidine-2,4,6-triamine
CID 80836329
6-N-methyl-4-N-[(1-methylpyrrolidin-3-yl)methyl]pyrimidine-2,4,6-triamine
CID 80791244
6-hydrazinyl-2-methylsulfanyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine
CID 80922985
4-N-(2,2-difluoroethyl)-6-N-methylpyrimidine-2,4,6-triamine
CID 115409505
6-N-methyl-4-N-[(5-methylfuran-2-yl)methyl]pyrimidine-2,4,6-triamine
CID 80832161
4-N-[4-(dimethylamino)butyl]-6-N-methylpyrimidine-2,4,6-triamine
CID 80817210
6-N-methyl-4-N-(3-phenylpropyl)pyrimidine-2,4,6-triamine
CID 80791770

Frequently Asked Questions

What is the IUPAC name of 6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine?
The IUPAC name of 6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine (CID 80848372) is 6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine.
What is the SMILES notation for 6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine?
The canonical SMILES for 6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine is CNc1cc(NCC2C(C)(C)C2(C)C)nc(N)n1.
What is the InChIKey of 6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine?
The InChIKey is ZNXUTOHBBNQMSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-12(2)8(13(12,3)4)7-16-10-6-9(15-5)17-11(14)18-10/h6,8H,7H2,1-5H3,(H4,14,15,16,17,18).
What are the key properties of 6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine?
6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine has a molecular weight of 249.36 g/mol, XLogP of 2.19, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-methyl-4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-2,4,6-triamine is sourced from PubChem (CID 80848372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).