N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine

C14H23N3 — CID 65413212

IUPACN-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine
SMILESCCNc1ccnc(C2CCCC(CC)C2)n1
InChIInChI=1S/C14H23N3/c1-3-11-6-5-7-12(10-11)14-16-9-8-13(17-14)15-4-2/h8-9,11-12H,3-7,10H2,1-2H3,(H,15,16,17)
InChIKeyZEONKNJJLYPALQ-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.59
Rot. Bonds4

About N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine

N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine (PubChem CID 65413212) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine
PubChem CID65413212
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine
SMILESCCNc1ccnc(C2CCCC(CC)C2)n1
InChIInChI=1S/C14H23N3/c1-3-11-6-5-7-12(10-11)14-16-9-8-13(17-14)15-4-2/h8-9,11-12H,3-7,10H2,1-2H3,(H,15,16,17)
InChIKeyZEONKNJJLYPALQ-UHFFFAOYSA-N
XLogP3.59
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 ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(3-ethylcyclohexyl)pyrimidin-4-yl]methanol
CID 65415658
2-(4-ethylcyclohexyl)-N-methylpyrimidin-4-amine
CID 65391328
2-(3-ethylcyclopentyl)pyrimidine-4-carboxylic acid
CID 65405640
2-[2-(3-ethylcyclopentyl)pyrimidin-4-yl]ethanamine
CID 65403501
N-ethyl-2-(3-ethylcyclopentyl)-6-propylpyrimidin-4-amine
CID 65405998
2-(3-ethylcyclohexyl)-5-iodo-N-methylpyrimidin-4-amine
CID 66302086
2-(3-ethylcyclohexyl)-6-methyl-N-propylpyrimidin-4-amine
CID 65413615
4-N-(cyclobutylmethyl)-2-cyclopropyl-6-N-ethylpyrimidine-4,6-diamine
CID 80968066
2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine
CID 65415033
methyl 4-[(3-ethylcyclohexyl)amino]pyrimidine-2-carboxylate
CID 66287288
2-N-ethyl-4-N-(3-ethylcyclohexyl)-5-methylpyrimidine-2,4-diamine
CID 80840988
4-amino-2-(3-ethylcyclohexyl)pyrimidine-5-carbonitrile
CID 65413263

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine (CID 65413212) is N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine is CCNc1ccnc(C2CCCC(CC)C2)n1.
What is the InChIKey of N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine?
The InChIKey is ZEONKNJJLYPALQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-11-6-5-7-12(10-11)14-16-9-8-13(17-14)15-4-2/h8-9,11-12H,3-7,10H2,1-2H3,(H,15,16,17).
What are the key properties of N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine?
N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine has a molecular weight of 233.36 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine is sourced from PubChem (CID 65413212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).