6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine

C10H19N5O — CID 102701909

IUPAC6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine
SMILESCCNc1cc(NCC(C)OC)nc(N)n1
InChIInChI=1S/C10H19N5O/c1-4-12-8-5-9(15-10(11)14-8)13-6-7(2)16-3/h5,7H,4,6H2,1-3H3,(H4,11,12,13,14,15)
InChIKeyRNYVDNYWYQFCTA-UHFFFAOYSA-N
MW225.30 g/mol
LogP0.94
Rot. Bonds6

About 6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine

6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine (PubChem CID 102701909) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is 6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine.

Molecular Properties

Compound Name6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine
PubChem CID102701909
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC Name6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine
SMILESCCNc1cc(NCC(C)OC)nc(N)n1
InChIInChI=1S/C10H19N5O/c1-4-12-8-5-9(15-10(11)14-8)13-6-7(2)16-3/h5,7H,4,6H2,1-3H3,(H4,11,12,13,14,15)
InChIKeyRNYVDNYWYQFCTA-UHFFFAOYSA-N
XLogP0.94
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

6-N-ethyl-4-N-(2,3,3-trimethylbutyl)pyrimidine-2,4,6-triamine
CID 83146706
6-hydrazinyl-N-(2-methoxypropyl)-2-methylpyrimidin-4-amine
CID 102701972
4-N-ethyl-6-N-methylpyrimidine-2,4,6-triamine
CID 80769889
6-N-ethyl-4-N-(1-methoxy-3-methylbutan-2-yl)pyrimidine-2,4,6-triamine
CID 80840157
6-N-ethyl-4-N-(2-piperidin-1-ylpropyl)pyrimidine-2,4,6-triamine
CID 80819636
6-chloro-4-N-(2-ethoxypropyl)pyrimidine-2,4-diamine
CID 115658236
4-N-tert-butyl-6-N-ethylpyrimidine-2,4,6-triamine
CID 80768954
4-N-(2-methoxypropyl)-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106773341
6-N-methyl-4-N-(2-methylpropyl)pyrimidine-2,4,6-triamine
CID 80770072
6-ethoxy-4-N-ethylpyrimidine-2,4-diamine
CID 80858129
6-N-ethyl-4-N-(1-methoxypentan-2-yl)pyrimidine-2,4,6-triamine
CID 80837603
methyl 3-[[2-amino-6-(ethylamino)pyrimidin-4-yl]amino]propanoate
CID 80797128

Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine?
The IUPAC name of 6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine (CID 102701909) is 6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine.
What is the SMILES notation for 6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine?
The canonical SMILES for 6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine is CCNc1cc(NCC(C)OC)nc(N)n1.
What is the InChIKey of 6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine?
The InChIKey is RNYVDNYWYQFCTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-4-12-8-5-9(15-10(11)14-8)13-6-7(2)16-3/h5,7H,4,6H2,1-3H3,(H4,11,12,13,14,15).
What are the key properties of 6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine?
6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine has a molecular weight of 225.30 g/mol, XLogP of 0.94, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-4-N-(2-methoxypropyl)pyrimidine-2,4,6-triamine is sourced from PubChem (CID 102701909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).