2-cyclopropyloxy-N-methylpyrimidin-5-amine

C8H11N3O — CID 155298367

IUPAC2-cyclopropyloxy-N-methylpyrimidin-5-amine
SMILESCNc1cnc(OC2CC2)nc1
InChIInChI=1S/C8H11N3O/c1-9-6-4-10-8(11-5-6)12-7-2-3-7/h4-5,7,9H,2-3H2,1H3
InChIKeyHNWULWYCTLHXHQ-UHFFFAOYSA-N
MW165.20 g/mol
LogP1.06
Rot. Bonds3

About 2-cyclopropyloxy-N-methylpyrimidin-5-amine

2-cyclopropyloxy-N-methylpyrimidin-5-amine (PubChem CID 155298367) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 2-cyclopropyloxy-N-methylpyrimidin-5-amine.

Molecular Properties

Compound Name2-cyclopropyloxy-N-methylpyrimidin-5-amine
PubChem CID155298367
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name2-cyclopropyloxy-N-methylpyrimidin-5-amine
SMILESCNc1cnc(OC2CC2)nc1
InChIInChI=1S/C8H11N3O/c1-9-6-4-10-8(11-5-6)12-7-2-3-7/h4-5,7,9H,2-3H2,1H3
InChIKeyHNWULWYCTLHXHQ-UHFFFAOYSA-N
XLogP1.06
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyloxy-N-methylpyrimidin-5-amine?
The IUPAC name of 2-cyclopropyloxy-N-methylpyrimidin-5-amine (CID 155298367) is 2-cyclopropyloxy-N-methylpyrimidin-5-amine.
What is the SMILES notation for 2-cyclopropyloxy-N-methylpyrimidin-5-amine?
The canonical SMILES for 2-cyclopropyloxy-N-methylpyrimidin-5-amine is CNc1cnc(OC2CC2)nc1.
What is the InChIKey of 2-cyclopropyloxy-N-methylpyrimidin-5-amine?
The InChIKey is HNWULWYCTLHXHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-9-6-4-10-8(11-5-6)12-7-2-3-7/h4-5,7,9H,2-3H2,1H3.
What are the key properties of 2-cyclopropyloxy-N-methylpyrimidin-5-amine?
2-cyclopropyloxy-N-methylpyrimidin-5-amine has a molecular weight of 165.20 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyloxy-N-methylpyrimidin-5-amine is sourced from PubChem (CID 155298367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).