6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine

C14H24N4O — CID 66329378

IUPAC6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
SMILESCC(CN1CCCC1)Nc1cc(OC(C)C)ncn1
InChIInChI=1S/C14H24N4O/c1-11(2)19-14-8-13(15-10-16-14)17-12(3)9-18-6-4-5-7-18/h8,10-12H,4-7,9H2,1-3H3,(H,15,16,17)
InChIKeyZMGMREVAOVVJFK-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.16
Rot. Bonds6

About 6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine

6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine (PubChem CID 66329378) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
PubChem CID66329378
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
SMILESCC(CN1CCCC1)Nc1cc(OC(C)C)ncn1
InChIInChI=1S/C14H24N4O/c1-11(2)19-14-8-13(15-10-16-14)17-12(3)9-18-6-4-5-7-18/h8,10-12H,4-7,9H2,1-3H3,(H,15,16,17)
InChIKeyZMGMREVAOVVJFK-UHFFFAOYSA-N
XLogP2.16
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-cyclopropylpropan-2-yl)-6-propan-2-yloxypyrimidin-4-amine
CID 66330794
1-N,1-N-dimethyl-2-N-(6-propan-2-yloxypyrimidin-4-yl)propane-1,2-diamine
CID 82938650
N-(4-methoxybutan-2-yl)-6-propan-2-yloxypyrimidin-4-amine
CID 66329609
N-(1-piperidin-1-ylpropan-2-yl)-4-propan-2-yloxypyrimidin-2-amine
CID 115974723
N-(1-morpholin-4-ylpropan-2-yl)-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 133291179
N-cyclohexyl-6-propan-2-yloxypyrimidin-4-amine
CID 66326722
2-[(6-propan-2-yloxypyrimidin-4-yl)amino]propanamide
CID 66329750
N-[(2S)-1-(3,5-dimethylpyrazol-1-yl)propan-2-yl]-6-methoxypyrimidin-4-amine
CID 95127371
(2S)-4-methyl-2-[(6-propan-2-yloxypyrimidin-4-yl)amino]pentanoic acid
CID 122050022
1-(azepan-1-yl)-3-[(6-methoxypyrimidin-4-yl)amino]propan-2-ol
CID 50980830
6-hydrazinyl-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
CID 80897697
5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine
CID 61474336

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine?
The IUPAC name of 6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine (CID 66329378) is 6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine?
The canonical SMILES for 6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine is CC(CN1CCCC1)Nc1cc(OC(C)C)ncn1.
What is the InChIKey of 6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine?
The InChIKey is ZMGMREVAOVVJFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-11(2)19-14-8-13(15-10-16-14)17-12(3)9-18-6-4-5-7-18/h8,10-12H,4-7,9H2,1-3H3,(H,15,16,17).
What are the key properties of 6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine?
6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine has a molecular weight of 264.37 g/mol, XLogP of 2.16, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yloxy-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 66329378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).