4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine

C14H26N4O — CID 80935470

IUPAC4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine
SMILESCCc1nc(NC)cc(N(CCOC)C(C)CC)n1
InChIInChI=1S/C14H26N4O/c1-6-11(3)18(8-9-19-5)14-10-13(15-4)16-12(7-2)17-14/h10-11H,6-9H2,1-5H3,(H,15,16,17)
InChIKeyZTHKXGGMANAVMB-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.33
Rot. Bonds8

About 4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine

4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine (PubChem CID 80935470) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine
PubChem CID80935470
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine
SMILESCCc1nc(NC)cc(N(CCOC)C(C)CC)n1
InChIInChI=1S/C14H26N4O/c1-6-11(3)18(8-9-19-5)14-10-13(15-4)16-12(7-2)17-14/h10-11H,6-9H2,1-5H3,(H,15,16,17)
InChIKeyZTHKXGGMANAVMB-UHFFFAOYSA-N
XLogP2.33
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-(1-cyclopropylethyl)-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine
CID 80934874
4-N-(2-methoxyethyl)-4-N-(1-methoxypropan-2-yl)-6-N-methyl-2-propylpyrimidine-4,6-diamine
CID 80942440
2-ethyl-4-N-(2-methoxyethyl)-6-N-methyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine
CID 80935014
2-ethyl-6-hydrazinyl-N-(2-methoxyethyl)-N-propan-2-ylpyrimidin-4-amine
CID 82965305
4-N-butan-2-yl-2-ethyl-4-N,6-N-dimethylpyrimidine-4,6-diamine
CID 80934109
4-N,4-N-bis(2-methoxyethyl)-6-N-methyl-2-propylpyrimidine-4,6-diamine
CID 80955285
2-(methoxymethyl)-6-N-methyl-4-N-propan-2-yl-4-N-propylpyrimidine-4,6-diamine
CID 113401338
4-N-butan-2-yl-4-N-butyl-6-N,2-diethylpyrimidine-4,6-diamine
CID 80934873
4-N,2-diethyl-6-N-methyl-4-N-(2-methylbutyl)pyrimidine-4,6-diamine
CID 80941500
4-N-butan-2-yl-4-N-(2-methoxyethyl)-6-methylpyrimidine-2,4-diamine
CID 80810126
4-N,4-N-bis(2-methoxyethyl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80962058
N-butan-2-yl-N-(2-methoxyethyl)-6-(methylaminomethyl)pyrazin-2-amine
CID 66451443

Frequently Asked Questions

What is the IUPAC name of 4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine (CID 80935470) is 4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine is CCc1nc(NC)cc(N(CCOC)C(C)CC)n1.
What is the InChIKey of 4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine?
The InChIKey is ZTHKXGGMANAVMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-6-11(3)18(8-9-19-5)14-10-13(15-4)16-12(7-2)17-14/h10-11H,6-9H2,1-5H3,(H,15,16,17).
What are the key properties of 4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine?
4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine has a molecular weight of 266.39 g/mol, XLogP of 2.33, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-butan-2-yl-2-ethyl-4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,6-diamine is sourced from PubChem (CID 80935470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).