4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine

C15H27N5 — CID 114506573

IUPAC4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine
SMILESCNc1cc(NC2CCN(C)CC2C)nc(C(C)C)n1
InChIInChI=1S/C15H27N5/c1-10(2)15-18-13(16-4)8-14(19-15)17-12-6-7-20(5)9-11(12)3/h8,10-12H,6-7,9H2,1-5H3,(H2,16,17,18,19)
InChIKeyUZORUPZSRNHANZ-UHFFFAOYSA-N
MW277.42 g/mol
LogP2.39
Rot. Bonds4

About 4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine

4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine (PubChem CID 114506573) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine
PubChem CID114506573
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine
SMILESCNc1cc(NC2CCN(C)CC2C)nc(C(C)C)n1
InChIInChI=1S/C15H27N5/c1-10(2)15-18-13(16-4)8-14(19-15)17-12-6-7-20(5)9-11(12)3/h8,10-12H,6-7,9H2,1-5H3,(H2,16,17,18,19)
InChIKeyUZORUPZSRNHANZ-UHFFFAOYSA-N
XLogP2.39
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80961487
2-[(1,3-dimethylpiperidin-4-yl)amino]-6-propan-2-ylpyridine-4-carboxylic acid
CID 114504534
2-cyclopropyl-N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinylpyrimidin-4-amine
CID 114506697
N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 114506710
4-N-(1,3-dimethylpiperidin-4-yl)-5-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 114506658
4-N-(1,3-dimethylpiperidin-4-yl)-6-N-ethyl-2-propylpyrimidine-4,6-diamine
CID 114506472
2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine
CID 114503076
4-N-(4-ethylcyclohexyl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80961149
2-N-(1,3-dimethylpiperidin-4-yl)pyridine-2,5-diamine
CID 114502996
4-N,6-N-dimethyl-4-N-(1-methylpiperidin-3-yl)-2-propan-2-ylpyrimidine-4,6-diamine
CID 80957454
6-(3,5-dimethylpiperidin-1-yl)-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80956223
6-methyl-N-(2-methylcyclohexyl)-2-propan-2-ylpyrimidin-4-amine
CID 43395279

Frequently Asked Questions

What is the IUPAC name of 4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine (CID 114506573) is 4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine is CNc1cc(NC2CCN(C)CC2C)nc(C(C)C)n1.
What is the InChIKey of 4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine?
The InChIKey is UZORUPZSRNHANZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-10(2)15-18-13(16-4)8-14(19-15)17-12-6-7-20(5)9-11(12)3/h8,10-12H,6-7,9H2,1-5H3,(H2,16,17,18,19).
What are the key properties of 4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine?
4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine has a molecular weight of 277.42 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine is sourced from PubChem (CID 114506573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).