N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine

C14H23N3 — CID 65415234

IUPACN,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine
SMILESCCNc1cc(CC)nc(C2CCC(C)C2)n1
InChIInChI=1S/C14H23N3/c1-4-12-9-13(15-5-2)17-14(16-12)11-7-6-10(3)8-11/h9-11H,4-8H2,1-3H3,(H,15,16,17)
InChIKeyXOHHYZLBCOEEIT-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.37
Rot. Bonds4

About N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine

N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine (PubChem CID 65415234) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine
PubChem CID65415234
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine
SMILESCCNc1cc(CC)nc(C2CCC(C)C2)n1
InChIInChI=1S/C14H23N3/c1-4-12-9-13(15-5-2)17-14(16-12)11-7-6-10(3)8-11/h9-11H,4-8H2,1-3H3,(H,15,16,17)
InChIKeyXOHHYZLBCOEEIT-UHFFFAOYSA-N
XLogP3.37
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclooctyl-N,6-diethylpyrimidin-4-amine
CID 80609911
N-ethyl-2-(3-ethylcyclopentyl)-6-propylpyrimidin-4-amine
CID 65405998
6-ethyl-N-methyl-2-(4-methylcyclohexyl)pyrimidin-4-amine
CID 55045483
2-cyclopropyl-6-N-ethyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-4,6-diamine
CID 107415826
2-cyclopropyl-6-N-ethyl-4-N-(4-methylcyclohexyl)pyrimidine-4,6-diamine
CID 80968126
2-cyclopropyl-N-ethyl-6-(methoxymethyl)pyrimidin-4-amine
CID 62320790
2-cyclooctyl-N-ethyl-6-propylpyrimidin-4-amine
CID 80609287
6-ethyl-2-(4-ethylcyclohexyl)-N-propylpyrimidin-4-amine
CID 65390933
N-ethyl-6-(methoxymethyl)-2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pyrimidin-4-amine
CID 115998400
N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine
CID 65415250
2-(5,6-dimethyl-1,4-dithian-2-yl)-N,6-diethylpyrimidin-4-amine
CID 103346600
4-N-(2,4-dimethylcyclohexyl)-6-N,2-diethylpyrimidine-4,6-diamine
CID 80935219

Frequently Asked Questions

What is the IUPAC name of N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine?
The IUPAC name of N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine (CID 65415234) is N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine.
What is the SMILES notation for N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine?
The canonical SMILES for N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine is CCNc1cc(CC)nc(C2CCC(C)C2)n1.
What is the InChIKey of N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine?
The InChIKey is XOHHYZLBCOEEIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-4-12-9-13(15-5-2)17-14(16-12)11-7-6-10(3)8-11/h9-11H,4-8H2,1-3H3,(H,15,16,17).
What are the key properties of N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine?
N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine has a molecular weight of 233.36 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine is sourced from PubChem (CID 65415234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).