N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine

C14H25N3O2 — CID 80990512

IUPACN,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine
SMILESCCCOCCOc1nc(C(C)C)nc(NC)c1C
InChIInChI=1S/C14H25N3O2/c1-6-7-18-8-9-19-14-11(4)13(15-5)16-12(17-14)10(2)3/h10H,6-9H2,1-5H3,(H,15,16,17)
InChIKeyWVPBAKQFYDDSPA-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.76
Rot. Bonds8

About N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine

N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine (PubChem CID 80990512) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine.

Molecular Properties

Compound NameN,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine
PubChem CID80990512
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC NameN,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine
SMILESCCCOCCOc1nc(C(C)C)nc(NC)c1C
InChIInChI=1S/C14H25N3O2/c1-6-7-18-8-9-19-14-11(4)13(15-5)16-12(17-14)10(2)3/h10H,6-9H2,1-5H3,(H,15,16,17)
InChIKeyWVPBAKQFYDDSPA-UHFFFAOYSA-N
XLogP2.76
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-N,5-dimethyl-2-propan-2-yl-4-N-(3-propoxypropyl)pyrimidine-4,6-diamine
CID 82946495
N,5-dimethyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]-2-propan-2-ylpyrimidin-4-amine
CID 80989512
5-methyl-6-(4-methylpentoxy)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80989042
N,5-dimethyl-6-octan-2-yloxy-2-propan-2-ylpyrimidin-4-amine
CID 80988210
4-chloro-6-(2-ethoxyethoxy)-5-methyl-2-propan-2-ylpyrimidine
CID 80974281
2-ethyl-6-(2-methoxyethoxy)-N,5-dimethylpyrimidin-4-amine
CID 80988826
6-(furan-2-ylmethoxy)-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
CID 80989526
6-ethyl-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
CID 63560963
N-ethyl-5-methyl-6-(3-methylbut-3-enoxy)-2-propan-2-ylpyrimidin-4-amine
CID 114471199
4-chloro-6-[2-(3-methoxypropoxy)ethoxy]-5-methyl-2-propan-2-ylpyrimidine
CID 103177544
5-methyl-6-(2-propoxyethoxy)-N,2-dipropylpyrimidin-4-amine
CID 80991146
N,5-dimethyl-6-(4-methylcyclohexyl)oxy-2-propan-2-ylpyrimidin-4-amine
CID 80988345

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine?
The IUPAC name of N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine (CID 80990512) is N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine.
What is the SMILES notation for N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine?
The canonical SMILES for N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine is CCCOCCOc1nc(C(C)C)nc(NC)c1C.
What is the InChIKey of N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine?
The InChIKey is WVPBAKQFYDDSPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-6-7-18-8-9-19-14-11(4)13(15-5)16-12(17-14)10(2)3/h10H,6-9H2,1-5H3,(H,15,16,17).
What are the key properties of N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine?
N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine has a molecular weight of 267.37 g/mol, XLogP of 2.76, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-2-propan-2-yl-6-(2-propoxyethoxy)pyrimidin-4-amine is sourced from PubChem (CID 80990512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).