2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine

C10H18N4O — CID 80786237

IUPAC2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine
SMILESCCNc1nccc(NC(C)COC)n1
InChIInChI=1S/C10H18N4O/c1-4-11-10-12-6-5-9(14-10)13-8(2)7-15-3/h5-6,8H,4,7H2,1-3H3,(H2,11,12,13,14)
InChIKeyVPZUZBPBEGVXCK-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.36
Rot. Bonds6

About 2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine

2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine (PubChem CID 80786237) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine
PubChem CID80786237
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine
SMILESCCNc1nccc(NC(C)COC)n1
InChIInChI=1S/C10H18N4O/c1-4-11-10-12-6-5-9(14-10)13-8(2)7-15-3/h5-6,8H,4,7H2,1-3H3,(H2,11,12,13,14)
InChIKeyVPZUZBPBEGVXCK-UHFFFAOYSA-N
XLogP1.36
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-ethyl-4-N-(1-methoxybutan-2-yl)pyrimidine-2,4-diamine
CID 80837494
2-N-ethyl-4-N-propan-2-ylpyrimidine-2,4-diamine
CID 80765362
4-N-[4-(dimethylamino)butan-2-yl]-2-N-ethylpyrimidine-2,4-diamine
CID 80807193
2-N-ethyl-4-N-(1-thiophen-2-ylpropan-2-yl)pyrimidine-2,4-diamine
CID 80830294
2-N,4-N-di(butan-2-yl)pyrimidine-2,4-diamine
CID 112883470
N-(1-methoxypropan-2-yl)-4-methylpyrimidin-2-amine
CID 62958383
2-N-ethyl-4-N-[1-(5-methylfuran-2-yl)ethyl]pyrimidine-2,4-diamine
CID 80800278
1-[[2-(ethylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80779056
4-N-butan-2-yl-2-N-(3-methylbutyl)pyrimidine-2,4-diamine
CID 112883545
4-N-(1-methoxybutan-2-yl)-2-N-methylpyrimidine-2,4-diamine
CID 80837219
2-N-ethyl-4-N-(2-methyl-1-thiophen-2-ylpropyl)pyrimidine-2,4-diamine
CID 80808164
2-N-ethyl-4-N-[1-(2-methylphenyl)ethyl]pyrimidine-2,4-diamine
CID 80801501

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine?
The IUPAC name of 2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine (CID 80786237) is 2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine.
What is the SMILES notation for 2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine?
The canonical SMILES for 2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine is CCNc1nccc(NC(C)COC)n1.
What is the InChIKey of 2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine?
The InChIKey is VPZUZBPBEGVXCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-11-10-12-6-5-9(14-10)13-8(2)7-15-3/h5-6,8H,4,7H2,1-3H3,(H2,11,12,13,14).
What are the key properties of 2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine?
2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine has a molecular weight of 210.28 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-2,4-diamine is sourced from PubChem (CID 80786237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).