4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine

C8H15N5 — CID 80770931

IUPAC4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine
SMILESCN(C)CCNc1cc(N)ncn1
InChIInChI=1S/C8H15N5/c1-13(2)4-3-10-8-5-7(9)11-6-12-8/h5-6H,3-4H2,1-2H3,(H3,9,10,11,12)
InChIKeyGCMYVOFQTBOSER-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.03
Rot. Bonds4

About 4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine

4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine (PubChem CID 80770931) has the molecular formula C8H15N5 and a molecular weight of 181.24 g/mol. Its IUPAC name is 4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine
PubChem CID80770931
Molecular FormulaC8H15N5
Molecular Weight181.24 g/mol
Exact Mass181.13
IUPAC Name4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine
SMILESCN(C)CCNc1cc(N)ncn1
InChIInChI=1S/C8H15N5/c1-13(2)4-3-10-8-5-7(9)11-6-12-8/h5-6H,3-4H2,1-2H3,(H3,9,10,11,12)
InChIKeyGCMYVOFQTBOSER-UHFFFAOYSA-N
XLogP0.03
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N',N'-dimethyl-N-(6-methylpyrimidin-4-yl)ethane-1,2-diamine
CID 61225693
N-(6-methoxypyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 66325776
N-(6-ethylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 61234929
4-N-[4-[methyl(propan-2-yl)amino]butyl]pyrimidine-4,6-diamine
CID 80816494
N',N'-dimethyl-N-(6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine
CID 58337037
4-N-(4-tert-butylphenyl)-6-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine
CID 112857465
4-N-[2-(dimethylamino)ethyl]-2-methylpyrimidine-4,6-diamine
CID 80769589
4-N-cyclopropyl-6-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine
CID 112854687
6-N-[2-(dimethylamino)ethyl]-4-N-(2-methylphenyl)pyrimidine-4,6-diamine
CID 112857443
6-N-[2-(dimethylamino)ethyl]-4-N-(2,5-dimethylphenyl)pyrimidine-4,6-diamine
CID 112857450
N-[2-[(6-aminopyrimidin-4-yl)amino]ethyl]acetamide
CID 79006981
6-N-[2-(dimethylamino)ethyl]-4-N-(pyridin-4-ylmethyl)pyrimidine-4,6-diamine
CID 112857392

Frequently Asked Questions

What is the IUPAC name of 4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine?
The IUPAC name of 4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine (CID 80770931) is 4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine?
The canonical SMILES for 4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine is CN(C)CCNc1cc(N)ncn1.
What is the InChIKey of 4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine?
The InChIKey is GCMYVOFQTBOSER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5/c1-13(2)4-3-10-8-5-7(9)11-6-12-8/h5-6H,3-4H2,1-2H3,(H3,9,10,11,12).
What are the key properties of 4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine?
4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine has a molecular weight of 181.24 g/mol, XLogP of 0.03, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine is sourced from PubChem (CID 80770931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).