2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine

C12H20N4 — CID 80829505

IUPAC2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine
SMILESCc1nc(N)c(C)c(NC2CCCC2C)n1
InChIInChI=1S/C12H20N4/c1-7-5-4-6-10(7)16-12-8(2)11(13)14-9(3)15-12/h7,10H,4-6H2,1-3H3,(H3,13,14,15,16)
InChIKeyIBQRZNDNLNSKRV-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.28
Rot. Bonds2

About 2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine

2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine (PubChem CID 80829505) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine
PubChem CID80829505
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine
SMILESCc1nc(N)c(C)c(NC2CCCC2C)n1
InChIInChI=1S/C12H20N4/c1-7-5-4-6-10(7)16-12-8(2)11(13)14-9(3)15-12/h7,10H,4-6H2,1-3H3,(H3,13,14,15,16)
InChIKeyIBQRZNDNLNSKRV-UHFFFAOYSA-N
XLogP2.28
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dimethyl-4-N-(2-methylcyclopropyl)pyrimidine-4,6-diamine
CID 80826930
4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine
CID 80835086
2,5-dimethyl-4-N-(4-methylcyclohexyl)pyrimidine-4,6-diamine
CID 80771822
4-N-(2,6-dimethylpiperidin-1-yl)-2,5-dimethylpyrimidine-4,6-diamine
CID 83028090
6-N,5-dimethyl-4-N-(2-methylcyclopentyl)-2-propylpyrimidine-4,6-diamine
CID 80985581
6-N-ethyl-5-methyl-4-N-(2-methylcyclopentyl)-2-propylpyrimidine-4,6-diamine
CID 80985469
2-N-(2-methylcyclopentyl)pyridine-2,3-diamine
CID 63278381
6-hydrazinyl-5-methyl-N-(2-methylcyclohexyl)-2-propylpyrimidin-4-amine
CID 81001589
2-tert-butyl-6-N,5-dimethyl-4-N-(2-methylcyclohexyl)pyrimidine-4,6-diamine
CID 80981493
2-ethyl-6-N,5-dimethyl-4-N-(2-methylcyclohexyl)pyrimidine-4,6-diamine
CID 80981209
4-N-(1,1-dioxothiolan-3-yl)-2,5-dimethylpyrimidine-4,6-diamine
CID 80786199
2,5-dimethyl-4-N-propan-2-ylpyrimidine-4,6-diamine
CID 80766348

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine?
The IUPAC name of 2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine (CID 80829505) is 2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine?
The canonical SMILES for 2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine is Cc1nc(N)c(C)c(NC2CCCC2C)n1.
What is the InChIKey of 2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine?
The InChIKey is IBQRZNDNLNSKRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-7-5-4-6-10(7)16-12-8(2)11(13)14-9(3)15-12/h7,10H,4-6H2,1-3H3,(H3,13,14,15,16).
What are the key properties of 2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine?
2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine has a molecular weight of 220.32 g/mol, XLogP of 2.28, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 80829505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).