N-ethylpyrimido[5,4-d]pyrimidin-2-amine

C8H9N5 — CID 140978165

IUPACN-ethylpyrimido[5,4-d]pyrimidin-2-amine
SMILESCCNc1ncc2ncncc2n1
InChIInChI=1S/C8H9N5/c1-2-10-8-11-4-6-7(13-8)3-9-5-12-6/h3-5H,2H2,1H3,(H,10,11,13)
InChIKeyZTBOGQYNWALXIP-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.85
Rot. Bonds2

About N-ethylpyrimido[5,4-d]pyrimidin-2-amine

N-ethylpyrimido[5,4-d]pyrimidin-2-amine (PubChem CID 140978165) has the molecular formula C8H9N5 and a molecular weight of 175.19 g/mol. Its IUPAC name is N-ethylpyrimido[5,4-d]pyrimidin-2-amine.

Molecular Properties

Compound NameN-ethylpyrimido[5,4-d]pyrimidin-2-amine
PubChem CID140978165
Molecular FormulaC8H9N5
Molecular Weight175.19 g/mol
Exact Mass175.09
IUPAC NameN-ethylpyrimido[5,4-d]pyrimidin-2-amine
SMILESCCNc1ncc2ncncc2n1
InChIInChI=1S/C8H9N5/c1-2-10-8-11-4-6-7(13-8)3-9-5-12-6/h3-5H,2H2,1H3,(H,10,11,13)
InChIKeyZTBOGQYNWALXIP-UHFFFAOYSA-N
XLogP0.85
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-iodopyrimido[5,4-d]pyrimidine
CID 90082580
5-bromo-2-N-ethylpyrimidine-2,4-diamine
CID 80797744
6-N-ethyl-4-N-(3-methylphenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine
CID 15295223
5-chloro-2-N-ethyl-4-N-methylpyrimidine-2,4-diamine
CID 80769890
ethane;2-(ethylamino)pyrimidine-5-carbonitrile
CID 142425715
propane;pyrido[3,2-d]pyrimidine
CID 144881600
2-N,4-N,4-N-triethyl-5-methylpyrimidine-2,4-diamine
CID 80766610
4-N-tert-butyl-2-N-ethyl-5-methylpyrimidine-2,4-diamine
CID 80769091
2-(ethylamino)pyrimidine-5-carbaldehyde
CID 11400865
1-[[4-(dimethylamino)-2-(ethylamino)pyrimido[5,4-d]pyrimidin-6-yl]amino]butan-2-ol
CID 134520106
N-ethyl-5-(ethylaminomethyl)pyrimidin-2-amine
CID 102536247
N-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-5-methylpyrimidin-2-amine
CID 113427596

Frequently Asked Questions

What is the IUPAC name of N-ethylpyrimido[5,4-d]pyrimidin-2-amine?
The IUPAC name of N-ethylpyrimido[5,4-d]pyrimidin-2-amine (CID 140978165) is N-ethylpyrimido[5,4-d]pyrimidin-2-amine.
What is the SMILES notation for N-ethylpyrimido[5,4-d]pyrimidin-2-amine?
The canonical SMILES for N-ethylpyrimido[5,4-d]pyrimidin-2-amine is CCNc1ncc2ncncc2n1.
What is the InChIKey of N-ethylpyrimido[5,4-d]pyrimidin-2-amine?
The InChIKey is ZTBOGQYNWALXIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5/c1-2-10-8-11-4-6-7(13-8)3-9-5-12-6/h3-5H,2H2,1H3,(H,10,11,13).
What are the key properties of N-ethylpyrimido[5,4-d]pyrimidin-2-amine?
N-ethylpyrimido[5,4-d]pyrimidin-2-amine has a molecular weight of 175.19 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylpyrimido[5,4-d]pyrimidin-2-amine is sourced from PubChem (CID 140978165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).