5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine

C10H15N3O — CID 114600775

IUPAC5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine
SMILESCOc1cnc(NCC2CC2C)nc1
InChIInChI=1S/C10H15N3O/c1-7-3-8(7)4-11-10-12-5-9(14-2)6-13-10/h5-8H,3-4H2,1-2H3,(H,11,12,13)
InChIKeyQBFSEFWYVZAXPD-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.55
Rot. Bonds4

About 5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine

5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine (PubChem CID 114600775) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine.

Molecular Properties

Compound Name5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine
PubChem CID114600775
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine
SMILESCOc1cnc(NCC2CC2C)nc1
InChIInChI=1S/C10H15N3O/c1-7-3-8(7)4-11-10-12-5-9(14-2)6-13-10/h5-8H,3-4H2,1-2H3,(H,11,12,13)
InChIKeyQBFSEFWYVZAXPD-UHFFFAOYSA-N
XLogP1.55
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine?
The IUPAC name of 5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine (CID 114600775) is 5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine.
What is the SMILES notation for 5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine?
The canonical SMILES for 5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine is COc1cnc(NCC2CC2C)nc1.
What is the InChIKey of 5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine?
The InChIKey is QBFSEFWYVZAXPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-7-3-8(7)4-11-10-12-5-9(14-2)6-13-10/h5-8H,3-4H2,1-2H3,(H,11,12,13).
What are the key properties of 5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine?
5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine has a molecular weight of 193.25 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-[(2-methylcyclopropyl)methyl]pyrimidin-2-amine is sourced from PubChem (CID 114600775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).