6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine

C11H20N4 — CID 80946214

IUPAC6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine
SMILESCCCNc1cc(NC)nc(CCC)n1
InChIInChI=1S/C11H20N4/c1-4-6-9-14-10(12-3)8-11(15-9)13-7-5-2/h8H,4-7H2,1-3H3,(H2,12,13,14,15)
InChIKeyUJKMVYRYCFKUSS-UHFFFAOYSA-N
MW208.31 g/mol
LogP2.29
Rot. Bonds6

About 6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine

6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine (PubChem CID 80946214) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine
PubChem CID80946214
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine
SMILESCCCNc1cc(NC)nc(CCC)n1
InChIInChI=1S/C11H20N4/c1-4-6-9-14-10(12-3)8-11(15-9)13-7-5-2/h8H,4-7H2,1-3H3,(H2,12,13,14,15)
InChIKeyUJKMVYRYCFKUSS-UHFFFAOYSA-N
XLogP2.29
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-ethyl-6-N-methyl-2-propylpyrimidine-4,6-diamine
CID 80946507
4-N-butyl-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80946225
6-methyl-N,2-dipropylpyrimidin-4-amine
CID 6460821
4-N-[2-(diethylamino)ethyl]-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80940577
N-ethyl-2-[[6-(methylamino)-2-propylpyrimidin-4-yl]amino]ethanesulfonamide
CID 106343405
6-N-methyl-4-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]-2-propylpyrimidine-4,6-diamine
CID 80950114
6-N-methyl-2-propyl-4-N-(2,2,2-trifluoroethyl)pyrimidine-4,6-diamine
CID 80946119
6-N-methyl-4-N-propylpyrimidine-2,4,6-triamine
CID 80766256
4-N-(2,3-dimethylbutyl)-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80949730
6-N-methyl-2-propyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
CID 80945511
N-methyl-2-[[6-(methylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80955339
4-N-[2-(furan-2-yl)ethyl]-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80941818

Frequently Asked Questions

What is the IUPAC name of 6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine?
The IUPAC name of 6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine (CID 80946214) is 6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine.
What is the SMILES notation for 6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine?
The canonical SMILES for 6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine is CCCNc1cc(NC)nc(CCC)n1.
What is the InChIKey of 6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine?
The InChIKey is UJKMVYRYCFKUSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-4-6-9-14-10(12-3)8-11(15-9)13-7-5-2/h8H,4-7H2,1-3H3,(H2,12,13,14,15).
What are the key properties of 6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine?
6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine has a molecular weight of 208.31 g/mol, XLogP of 2.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine is sourced from PubChem (CID 80946214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).