N-(2-methylcyclopropyl)pyrimidin-4-amine

C8H11N3 — CID 62398968

IUPACN-(2-methylcyclopropyl)pyrimidin-4-amine
SMILESCC1CC1Nc1ccncn1
InChIInChI=1S/C8H11N3/c1-6-4-7(6)11-8-2-3-9-5-10-8/h2-3,5-7H,4H2,1H3,(H,9,10,11)
InChIKeyFKKXPTBBONUQJL-UHFFFAOYSA-N
MW149.20 g/mol
LogP1.30
Rot. Bonds2

About N-(2-methylcyclopropyl)pyrimidin-4-amine

N-(2-methylcyclopropyl)pyrimidin-4-amine (PubChem CID 62398968) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is N-(2-methylcyclopropyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-methylcyclopropyl)pyrimidin-4-amine
PubChem CID62398968
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC NameN-(2-methylcyclopropyl)pyrimidin-4-amine
SMILESCC1CC1Nc1ccncn1
InChIInChI=1S/C8H11N3/c1-6-4-7(6)11-8-2-3-9-5-10-8/h2-3,5-7H,4H2,1H3,(H,9,10,11)
InChIKeyFKKXPTBBONUQJL-UHFFFAOYSA-N
XLogP1.30
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclopropyl)pyrimidin-4-amine?
The IUPAC name of N-(2-methylcyclopropyl)pyrimidin-4-amine (CID 62398968) is N-(2-methylcyclopropyl)pyrimidin-4-amine.
What is the SMILES notation for N-(2-methylcyclopropyl)pyrimidin-4-amine?
The canonical SMILES for N-(2-methylcyclopropyl)pyrimidin-4-amine is CC1CC1Nc1ccncn1.
What is the InChIKey of N-(2-methylcyclopropyl)pyrimidin-4-amine?
The InChIKey is FKKXPTBBONUQJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3/c1-6-4-7(6)11-8-2-3-9-5-10-8/h2-3,5-7H,4H2,1H3,(H,9,10,11).
What are the key properties of N-(2-methylcyclopropyl)pyrimidin-4-amine?
N-(2-methylcyclopropyl)pyrimidin-4-amine has a molecular weight of 149.20 g/mol, XLogP of 1.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclopropyl)pyrimidin-4-amine is sourced from PubChem (CID 62398968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).