N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine

C8H17N3 — CID 91406826

IUPACN-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine
SMILESCCN(C)C1N=CCC(C)N1
InChIInChI=1S/C8H17N3/c1-4-11(3)8-9-6-5-7(2)10-8/h6-8,10H,4-5H2,1-3H3
InChIKeyQHZACMCFEWBIMZ-UHFFFAOYSA-N
MW155.24 g/mol
LogP0.67
Rot. Bonds2

About N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine

N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine (PubChem CID 91406826) has the molecular formula C8H17N3 and a molecular weight of 155.24 g/mol. Its IUPAC name is N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine.

Molecular Properties

Compound NameN-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine
PubChem CID91406826
Molecular FormulaC8H17N3
Molecular Weight155.24 g/mol
Exact Mass155.14
IUPAC NameN-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine
SMILESCCN(C)C1N=CCC(C)N1
InChIInChI=1S/C8H17N3/c1-4-11(3)8-9-6-5-7(2)10-8/h6-8,10H,4-5H2,1-3H3
InChIKeyQHZACMCFEWBIMZ-UHFFFAOYSA-N
XLogP0.67
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine?
The IUPAC name of N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine (CID 91406826) is N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine.
What is the SMILES notation for N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine?
The canonical SMILES for N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine is CCN(C)C1N=CCC(C)N1.
What is the InChIKey of N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine?
The InChIKey is QHZACMCFEWBIMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3/c1-4-11(3)8-9-6-5-7(2)10-8/h6-8,10H,4-5H2,1-3H3.
What are the key properties of N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine?
N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine has a molecular weight of 155.24 g/mol, XLogP of 0.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,6-dimethyl-1,2,5,6-tetrahydropyrimidin-2-amine is sourced from PubChem (CID 91406826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).