N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine

C18H31N3 — CID 65402188

IUPACN,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine
SMILESCCCC1CCC(c2nc(C)c(CC)c(NCC)n2)CC1
InChIInChI=1S/C18H31N3/c1-5-8-14-9-11-15(12-10-14)17-20-13(4)16(6-2)18(21-17)19-7-3/h14-15H,5-12H2,1-4H3,(H,19,20,21)
InChIKeyPKEIGWMOJRHHGC-UHFFFAOYSA-N
MW289.47 g/mol
LogP4.85
Rot. Bonds6

About N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine

N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine (PubChem CID 65402188) has the molecular formula C18H31N3 and a molecular weight of 289.47 g/mol. Its IUPAC name is N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine
PubChem CID65402188
Molecular FormulaC18H31N3
Molecular Weight289.47 g/mol
Exact Mass289.25
IUPAC NameN,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine
SMILESCCCC1CCC(c2nc(C)c(CC)c(NCC)n2)CC1
InChIInChI=1S/C18H31N3/c1-5-8-14-9-11-15(12-10-14)17-20-13(4)16(6-2)18(21-17)19-7-3/h14-15H,5-12H2,1-4H3,(H,19,20,21)
InChIKeyPKEIGWMOJRHHGC-UHFFFAOYSA-N
XLogP4.85
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.47
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4,4-dimethylcyclohexyl)-N,5-diethyl-6-methylpyrimidin-4-amine
CID 65390273
[6-methyl-5-propan-2-yl-2-(4-propylcyclohexyl)pyrimidin-4-yl]hydrazine
CID 65401375
6-cyclopropyl-N-ethyl-2-(4-propylcyclohexyl)pyrimidin-4-amine
CID 65402191
2-cyclopropyl-6-(2-cyclopropylethoxy)-N-ethyl-5-methylpyrimidin-4-amine
CID 106207562
N,5-diethyl-6-methyl-2-(3-methyl-1,4-dithian-2-yl)pyrimidin-4-amine
CID 115388492
6-butylsulfanyl-2-cyclopropyl-N-ethyl-5-methylpyrimidin-4-amine
CID 80990882
N-ethyl-2-(3-ethylcyclopentyl)-5-iodo-6-methylpyrimidin-4-amine
CID 66305718
4-N-butyl-2-cyclopropyl-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80981195
4-methyl-5-propyl-2-(4-propylcyclohexyl)pyrimidine
CID 70493707
5-bromo-N-ethyl-6-methyl-2-(oxan-4-yl)pyrimidin-4-amine
CID 66306278
2-cyclopropyl-N-ethyl-5-methyl-6-pentylsulfanylpyrimidin-4-amine
CID 107765323
N-ethyl-6-propan-2-yl-2-(4-propylcyclohexyl)pyrimidin-4-amine
CID 65403198

Frequently Asked Questions

What is the IUPAC name of N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine?
The IUPAC name of N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine (CID 65402188) is N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine.
What is the SMILES notation for N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine?
The canonical SMILES for N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine is CCCC1CCC(c2nc(C)c(CC)c(NCC)n2)CC1.
What is the InChIKey of N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine?
The InChIKey is PKEIGWMOJRHHGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3/c1-5-8-14-9-11-15(12-10-14)17-20-13(4)16(6-2)18(21-17)19-7-3/h14-15H,5-12H2,1-4H3,(H,19,20,21).
What are the key properties of N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine?
N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine has a molecular weight of 289.47 g/mol, XLogP of 4.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-diethyl-6-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine is sourced from PubChem (CID 65402188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).