N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine

C10H15N3 — CID 167104726

IUPACN-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine
SMILESC=CN(c1ncncc1C)C(C)C
InChIInChI=1S/C10H15N3/c1-5-13(8(2)3)10-9(4)6-11-7-12-10/h5-8H,1H2,2-4H3
InChIKeyPUWAZLKLPBZREW-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.14
Rot. Bonds3

About N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine

N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine (PubChem CID 167104726) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine
PubChem CID167104726
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC NameN-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine
SMILESC=CN(c1ncncc1C)C(C)C
InChIInChI=1S/C10H15N3/c1-5-13(8(2)3)10-9(4)6-11-7-12-10/h5-8H,1H2,2-4H3
InChIKeyPUWAZLKLPBZREW-UHFFFAOYSA-N
XLogP2.14
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine (CID 167104726) is N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine is C=CN(c1ncncc1C)C(C)C.
What is the InChIKey of N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine?
The InChIKey is PUWAZLKLPBZREW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-5-13(8(2)3)10-9(4)6-11-7-12-10/h5-8H,1H2,2-4H3.
What are the key properties of N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine?
N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine has a molecular weight of 177.25 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-5-methyl-N-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 167104726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).