1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine

C10H18N4O — CID 112684646

IUPAC1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine
SMILESCOc1ccnc(NCC(C)N(C)C)n1
InChIInChI=1S/C10H18N4O/c1-8(14(2)3)7-12-10-11-6-5-9(13-10)15-4/h5-6,8H,7H2,1-4H3,(H,11,12,13)
InChIKeyPUOUYPKGTTYQOK-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.85
Rot. Bonds5

About 1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine

1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine (PubChem CID 112684646) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine
PubChem CID112684646
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine
SMILESCOc1ccnc(NCC(C)N(C)C)n1
InChIInChI=1S/C10H18N4O/c1-8(14(2)3)7-12-10-11-6-5-9(13-10)15-4/h5-6,8H,7H2,1-4H3,(H,11,12,13)
InChIKeyPUOUYPKGTTYQOK-UHFFFAOYSA-N
XLogP0.85
TPSA50.28 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 ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-N,2-N-diethyl-1-N-(4-methoxypyrimidin-2-yl)-4-methylpentane-1,2-diamine
CID 56684317
1-(4-methoxyphenyl)-N'-(4-methoxypyrimidin-2-yl)-N,N-dimethylethane-1,2-diamine
CID 47012924
N'-(4-methoxypyrimidin-2-yl)-N,N-dimethyl-1-(4-methylphenyl)ethane-1,2-diamine
CID 102555419
N-(3-chloro-2-methylpropyl)-4-methoxypyrimidin-2-amine
CID 65036818
N-ethyl-4-methoxypyrimidin-2-amine
CID 20510275
3-amino-4-[(4-methoxypyrimidin-2-yl)amino]butan-2-ol
CID 64541292
N-(4-methoxypyrimidin-2-yl)-2-methylbutane-1,4-diamine
CID 66089762
N-(4-methoxypyrimidin-2-yl)-N'-propan-2-ylethane-1,2-diamine
CID 62664484
N-(4-methoxypyrimidin-2-yl)-N',N'-dimethylpropane-1,3-diamine
CID 112683349
N-[2-(furan-2-yl)-2-methoxyethyl]-4-methoxypyrimidin-2-amine
CID 172904275
N-(2,3-dimethylbutyl)-4-ethoxypyrimidin-2-amine
CID 112637900
1-[(4-methoxypyrimidin-2-yl)amino]pentan-3-ol
CID 115702045

Frequently Asked Questions

What is the IUPAC name of 1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine?
The IUPAC name of 1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine (CID 112684646) is 1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine.
What is the SMILES notation for 1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine?
The canonical SMILES for 1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine is COc1ccnc(NCC(C)N(C)C)n1.
What is the InChIKey of 1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine?
The InChIKey is PUOUYPKGTTYQOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-8(14(2)3)7-12-10-11-6-5-9(13-10)15-4/h5-6,8H,7H2,1-4H3,(H,11,12,13).
What are the key properties of 1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine?
1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine has a molecular weight of 210.28 g/mol, XLogP of 0.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine is sourced from PubChem (CID 112684646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).