6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine

C14H23N3O — CID 144655365

IUPAC6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine
SMILESCCc1cc(N(C)C2CCC(OC)CC2)ncn1
InChIInChI=1S/C14H23N3O/c1-4-11-9-14(16-10-15-11)17(2)12-5-7-13(18-3)8-6-12/h9-10,12-13H,4-8H2,1-3H3
InChIKeyCZYVPKCKOUUPLW-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.43
Rot. Bonds4

About 6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine

6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine (PubChem CID 144655365) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine
PubChem CID144655365
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine
SMILESCCc1cc(N(C)C2CCC(OC)CC2)ncn1
InChIInChI=1S/C14H23N3O/c1-4-11-9-14(16-10-15-11)17(2)12-5-7-13(18-3)8-6-12/h9-10,12-13H,4-8H2,1-3H3
InChIKeyCZYVPKCKOUUPLW-UHFFFAOYSA-N
XLogP2.43
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine?
The IUPAC name of 6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine (CID 144655365) is 6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine?
The canonical SMILES for 6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine is CCc1cc(N(C)C2CCC(OC)CC2)ncn1.
What is the InChIKey of 6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine?
The InChIKey is CZYVPKCKOUUPLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-4-11-9-14(16-10-15-11)17(2)12-5-7-13(18-3)8-6-12/h9-10,12-13H,4-8H2,1-3H3.
What are the key properties of 6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine?
6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 2.43, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-(4-methoxycyclohexyl)-N-methylpyrimidin-4-amine is sourced from PubChem (CID 144655365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).