2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine

C12H20N4 — CID 80955746

IUPAC2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine
SMILESCCCNc1cc(N(C)C)nc(C2CC2)n1
InChIInChI=1S/C12H20N4/c1-4-7-13-10-8-11(16(2)3)15-12(14-10)9-5-6-9/h8-9H,4-7H2,1-3H3,(H,13,14,15)
InChIKeyFXSFHYKXWJVZTN-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.24
Rot. Bonds5

About 2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine

2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine (PubChem CID 80955746) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine
PubChem CID80955746
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine
SMILESCCCNc1cc(N(C)C)nc(C2CC2)n1
InChIInChI=1S/C12H20N4/c1-4-7-13-10-8-11(16(2)3)15-12(14-10)9-5-6-9/h8-9H,4-7H2,1-3H3,(H,13,14,15)
InChIKeyFXSFHYKXWJVZTN-UHFFFAOYSA-N
XLogP2.24
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-butyl-2-cyclopropyl-4-N-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80955798
2-cyclopropyl-4-N-(cyclopropylmethyl)-4-N-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80967188
2-cyclopropyl-4-N-methyl-4-N-(3-methylbutan-2-yl)-6-N-propylpyrimidine-4,6-diamine
CID 80967706
2-cyclopropyl-4-N-[3-(dimethylamino)propyl]-4-N-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80959411
4-N-(cyclobutylmethyl)-2-cyclopropyl-4-N-ethyl-6-N-propylpyrimidine-4,6-diamine
CID 107403149
2-cyclopropyl-4-N-methyl-4-N-(oxolan-3-yl)-6-N-propylpyrimidine-4,6-diamine
CID 82745448
2-cyclopropyl-4-N-(3-methoxypropyl)-4-N-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80957701
2-cyclopropyl-4-N-[3-(dimethylamino)propyl]-6-N-propylpyrimidine-4,6-diamine
CID 80966841
4-N,4-N-dimethyl-2-N,6-N-dipropylpyrimidine-2,4,6-triamine
CID 57103016
2-cyclopropyl-4-N-propylpyrimidine-4,6-diamine
CID 80956858
2-[[2-cyclopropyl-6-(propylamino)pyrimidin-4-yl]-ethylamino]-N-methylacetamide
CID 80961853
6-cyclopropyl-2-(4-methylcyclohexyl)-N-propylpyrimidin-4-amine
CID 63486835

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine?
The IUPAC name of 2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine (CID 80955746) is 2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine?
The canonical SMILES for 2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine is CCCNc1cc(N(C)C)nc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine?
The InChIKey is FXSFHYKXWJVZTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-4-7-13-10-8-11(16(2)3)15-12(14-10)9-5-6-9/h8-9H,4-7H2,1-3H3,(H,13,14,15).
What are the key properties of 2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine?
2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine has a molecular weight of 220.32 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-N,4-N-dimethyl-6-N-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 80955746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).