2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine

C11H18N4 — CID 105459654

IUPAC2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
SMILESCCc1nc2c(c(N(C)C)n1)CCNC2
InChIInChI=1S/C11H18N4/c1-4-10-13-9-7-12-6-5-8(9)11(14-10)15(2)3/h12H,4-7H2,1-3H3
InChIKeyNUMOGAZAUJTYFC-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.75
Rot. Bonds2

About 2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine

2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine (PubChem CID 105459654) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
PubChem CID105459654
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
SMILESCCc1nc2c(c(N(C)C)n1)CCNC2
InChIInChI=1S/C11H18N4/c1-4-10-13-9-7-12-6-5-8(9)11(14-10)15(2)3/h12H,4-7H2,1-3H3
InChIKeyNUMOGAZAUJTYFC-UHFFFAOYSA-N
XLogP0.75
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine?
The IUPAC name of 2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine (CID 105459654) is 2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine is CCc1nc2c(c(N(C)C)n1)CCNC2.
What is the InChIKey of 2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine?
The InChIKey is NUMOGAZAUJTYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-4-10-13-9-7-12-6-5-8(9)11(14-10)15(2)3/h12H,4-7H2,1-3H3.
What are the key properties of 2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine?
2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine has a molecular weight of 206.29 g/mol, XLogP of 0.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 105459654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).