2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine

C14H19N5 — CID 106715595

IUPAC2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
SMILESCC1CCC(c2nc(N)cc(-c3cnn(C)c3)n2)C1
InChIInChI=1S/C14H19N5/c1-9-3-4-10(5-9)14-17-12(6-13(15)18-14)11-7-16-19(2)8-11/h6-10H,3-5H2,1-2H3,(H2,15,17,18)
InChIKeyODPBYDCQXMPPFG-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.36
Rot. Bonds2

About 2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine

2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine (PubChem CID 106715595) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
PubChem CID106715595
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC Name2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
SMILESCC1CCC(c2nc(N)cc(-c3cnn(C)c3)n2)C1
InChIInChI=1S/C14H19N5/c1-9-3-4-10(5-9)14-17-12(6-13(15)18-14)11-7-16-19(2)8-11/h6-10H,3-5H2,1-2H3,(H2,15,17,18)
InChIKeyODPBYDCQXMPPFG-UHFFFAOYSA-N
XLogP2.36
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine?
The IUPAC name of 2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine (CID 106715595) is 2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine?
The canonical SMILES for 2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine is CC1CCC(c2nc(N)cc(-c3cnn(C)c3)n2)C1.
What is the InChIKey of 2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine?
The InChIKey is ODPBYDCQXMPPFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-9-3-4-10(5-9)14-17-12(6-13(15)18-14)11-7-16-19(2)8-11/h6-10H,3-5H2,1-2H3,(H2,15,17,18).
What are the key properties of 2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine?
2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine has a molecular weight of 257.34 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylcyclopentyl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine is sourced from PubChem (CID 106715595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).