N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine

C14H25N3O — CID 82454213

IUPACN-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine
SMILESCCc1nc(NC(C)CC)cc(OCC(C)C)n1
InChIInChI=1S/C14H25N3O/c1-6-11(5)15-13-8-14(18-9-10(3)4)17-12(7-2)16-13/h8,10-11H,6-7,9H2,1-5H3,(H,15,16,17)
InChIKeyPICNDLYNSPRVEY-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.28
Rot. Bonds7

About N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine

N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine (PubChem CID 82454213) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine.

Molecular Properties

Compound NameN-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine
PubChem CID82454213
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine
SMILESCCc1nc(NC(C)CC)cc(OCC(C)C)n1
InChIInChI=1S/C14H25N3O/c1-6-11(5)15-13-8-14(18-9-10(3)4)17-12(7-2)16-13/h8,10-11H,6-7,9H2,1-5H3,(H,15,16,17)
InChIKeyPICNDLYNSPRVEY-UHFFFAOYSA-N
XLogP3.28
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-butan-2-yl-2-cyclopropyl-6-(2-methylpropoxy)pyrimidin-4-amine
CID 82456492
N-cycloheptyl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine
CID 82454224
N-butan-2-yl-6-butoxy-2-propylpyrimidin-4-amine
CID 82454405
N-ethyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine
CID 80949979
2-ethyl-N-methyl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine
CID 80941741
N-tert-butyl-2-(methoxymethyl)-6-(2-methylpropoxy)pyrimidin-4-amine
CID 82456699
2-ethyl-6-hydrazinyl-N-(1-methoxypropan-2-yl)pyrimidin-4-amine
CID 80940815
6-N,2-diethyl-4-N-(1-methoxypropan-2-yl)pyrimidine-4,6-diamine
CID 80933516
N-cyclohexyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine
CID 82454277
2-ethyl-N-methyl-6-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-4-amine
CID 80942176
N,2-diethyl-6-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-4-amine
CID 80942175
2-ethyl-6-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyrimidin-4-amine
CID 82453724

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine?
The IUPAC name of N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine (CID 82454213) is N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine.
What is the SMILES notation for N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine?
The canonical SMILES for N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine is CCc1nc(NC(C)CC)cc(OCC(C)C)n1.
What is the InChIKey of N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine?
The InChIKey is PICNDLYNSPRVEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-6-11(5)15-13-8-14(18-9-10(3)4)17-12(7-2)16-13/h8,10-11H,6-7,9H2,1-5H3,(H,15,16,17).
What are the key properties of N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine?
N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine has a molecular weight of 251.37 g/mol, XLogP of 3.28, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-ethyl-6-(2-methylpropoxy)pyrimidin-4-amine is sourced from PubChem (CID 82454213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).