4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine

C10H18N4O — CID 82953136

IUPAC4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine
SMILESCOCCN(c1cc(N)ncn1)C(C)C
InChIInChI=1S/C10H18N4O/c1-8(2)14(4-5-15-3)10-6-9(11)12-7-13-10/h6-8H,4-5H2,1-3H3,(H2,11,12,13)
InChIKeyNNSJTTIBJGRMDV-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.92
Rot. Bonds5

About 4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine

4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine (PubChem CID 82953136) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine
PubChem CID82953136
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine
SMILESCOCCN(c1cc(N)ncn1)C(C)C
InChIInChI=1S/C10H18N4O/c1-8(2)14(4-5-15-3)10-6-9(11)12-7-13-10/h6-8H,4-5H2,1-3H3,(H2,11,12,13)
InChIKeyNNSJTTIBJGRMDV-UHFFFAOYSA-N
XLogP0.92
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-methyl-4-N-propan-2-ylpyrimidine-4,6-diamine
CID 80765054
4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine
CID 82948148
6-hydrazinyl-4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-2,4-diamine
CID 82965494
2-[2-methoxyethyl(propan-2-yl)amino]pyridine-4-carboxylic acid
CID 82951662
6-chloro-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)pyrimidin-4-amine
CID 55002940
5-chloro-2-N-(2-methoxyethyl)-2-N-propan-2-ylpyridine-2,3-diamine
CID 82949133
2-N-butan-2-yl-2-N-(2-methoxyethyl)-4-methylpyridine-2,5-diamine
CID 79176590
2-N-(2-methoxyethyl)-2-N-(1-methoxypropan-2-yl)-4-methylpyridine-2,5-diamine
CID 79175638
N-(2-methoxyethyl)-N-propan-2-yl-4-[1-(propylamino)ethyl]pyridin-2-amine
CID 82951129
4-N-butan-2-yl-4-N-(2-methoxyethyl)-2-methylsulfanylpyrimidine-4,6-diamine
CID 80820334
4-N-(2-methoxyethyl)-4-N-pentan-3-ylpyrimidine-2,4,6-triamine
CID 80821328
2-chloro-4-N-(2-methoxyethyl)-5-methyl-4-N-propan-2-ylbenzene-1,4-diamine
CID 82949127

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine (CID 82953136) is 4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine is COCCN(c1cc(N)ncn1)C(C)C.
What is the InChIKey of 4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine?
The InChIKey is NNSJTTIBJGRMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-8(2)14(4-5-15-3)10-6-9(11)12-7-13-10/h6-8H,4-5H2,1-3H3,(H2,11,12,13).
What are the key properties of 4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine?
4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine has a molecular weight of 210.28 g/mol, XLogP of 0.92, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-methoxyethyl)-4-N-propan-2-ylpyrimidine-4,6-diamine is sourced from PubChem (CID 82953136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).