6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine

C14H23N3 — CID 107419264

IUPAC6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
SMILESCCc1cc(NCC2CCCC2C)nc(C)n1
InChIInChI=1S/C14H23N3/c1-4-13-8-14(17-11(3)16-13)15-9-12-7-5-6-10(12)2/h8,10,12H,4-7,9H2,1-3H3,(H,15,16,17)
InChIKeyGTAFELMHCFVGTC-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.20
Rot. Bonds4

About 6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine

6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine (PubChem CID 107419264) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
PubChem CID107419264
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
SMILESCCc1cc(NCC2CCCC2C)nc(C)n1
InChIInChI=1S/C14H23N3/c1-4-13-8-14(17-11(3)16-13)15-9-12-7-5-6-10(12)2/h8,10,12H,4-7,9H2,1-3H3,(H,15,16,17)
InChIKeyGTAFELMHCFVGTC-UHFFFAOYSA-N
XLogP3.20
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 ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine (CID 107419264) is 6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine is CCc1cc(NCC2CCCC2C)nc(C)n1.
What is the InChIKey of 6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine?
The InChIKey is GTAFELMHCFVGTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-4-13-8-14(17-11(3)16-13)15-9-12-7-5-6-10(12)2/h8,10,12H,4-7,9H2,1-3H3,(H,15,16,17).
What are the key properties of 6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine?
6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine has a molecular weight of 233.36 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 107419264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).