2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine

C10H18N4O — CID 104556767

IUPAC2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine
SMILESCCOc1ccnc(N(C)C(C)CN)n1
InChIInChI=1S/C10H18N4O/c1-4-15-9-5-6-12-10(13-9)14(3)8(2)7-11/h5-6,8H,4,7,11H2,1-3H3
InChIKeyHNSVOVHICLFXFU-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.66
Rot. Bonds5

About 2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine

2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine (PubChem CID 104556767) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine
PubChem CID104556767
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine
SMILESCCOc1ccnc(N(C)C(C)CN)n1
InChIInChI=1S/C10H18N4O/c1-4-15-9-5-6-12-10(13-9)14(3)8(2)7-11/h5-6,8H,4,7,11H2,1-3H3
InChIKeyHNSVOVHICLFXFU-UHFFFAOYSA-N
XLogP0.66
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 ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-bromopropan-2-yl)-4-methoxy-N-methylpyrimidin-2-amine
CID 104555295
1-cyclopropyl-N-methyl-N-(4-propan-2-yloxypyrimidin-2-yl)ethane-1,2-diamine
CID 116653334
2-N-methyl-2-N-(2-methylpyrimidin-4-yl)propane-1,2-diamine
CID 82503810
2-(4-ethoxypyrimidin-2-yl)ethanamine
CID 112639157
3-[(4-ethoxypyrimidin-2-yl)-propan-2-ylamino]propanoic acid
CID 112635997
2-N-methyl-2-N-(5-methylpyrimidin-2-yl)propane-1,2-diamine
CID 104556690
2-(4-ethoxypyrimidin-2-yl)oxyethanamine
CID 112639005
2-[1-methoxypropan-2-yl(methyl)amino]pyrimidine-4-carbothioamide
CID 107546852
methyl 3-[(4-ethoxypyrimidin-2-yl)-methylamino]propanoate
CID 112638969
N'-butan-2-yl-N-(4-ethoxypyrimidin-2-yl)-N'-methylethane-1,2-diamine
CID 114134754
N'-(4-ethoxypyrimidin-2-yl)-N,N'-diethylethane-1,2-diamine
CID 112639133
N-butyl-N-(2-chloroethyl)-4-ethoxypyrimidin-2-amine
CID 112639176

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine?
The IUPAC name of 2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine (CID 104556767) is 2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine.
What is the SMILES notation for 2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine?
The canonical SMILES for 2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine is CCOc1ccnc(N(C)C(C)CN)n1.
What is the InChIKey of 2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine?
The InChIKey is HNSVOVHICLFXFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-15-9-5-6-12-10(13-9)14(3)8(2)7-11/h5-6,8H,4,7,11H2,1-3H3.
What are the key properties of 2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine?
2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine has a molecular weight of 210.28 g/mol, XLogP of 0.66, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-ethoxypyrimidin-2-yl)-2-N-methylpropane-1,2-diamine is sourced from PubChem (CID 104556767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).