N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine

C14H19N3O2 — CID 112636994

IUPACN-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine
SMILESCC(Cc1ccco1)Nc1nccc(OC(C)C)n1
InChIInChI=1S/C14H19N3O2/c1-10(2)19-13-6-7-15-14(17-13)16-11(3)9-12-5-4-8-18-12/h4-8,10-11H,9H2,1-3H3,(H,15,16,17)
InChIKeyROWBYQFKHMEQRX-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.90
Rot. Bonds6

About N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine

N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine (PubChem CID 112636994) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine
PubChem CID112636994
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine
SMILESCC(Cc1ccco1)Nc1nccc(OC(C)C)n1
InChIInChI=1S/C14H19N3O2/c1-10(2)19-13-6-7-15-14(17-13)16-11(3)9-12-5-4-8-18-12/h4-8,10-11H,9H2,1-3H3,(H,15,16,17)
InChIKeyROWBYQFKHMEQRX-UHFFFAOYSA-N
XLogP2.90
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-(furan-2-yl)propan-2-ylamino]pyrimidine-4-carbonitrile
CID 107543934
N-(1-chloropropan-2-yl)-4-propan-2-yloxypyrimidin-2-amine
CID 112639274
3-[(4-propan-2-yloxypyrimidin-2-yl)amino]butan-1-ol
CID 112638478
N-(1-cyclopropylpropan-2-yl)-4-propan-2-yloxypyrimidin-2-amine
CID 112637761
N-[1-(furan-2-yl)propan-2-yl]-5-iodopyrimidin-2-amine
CID 104840074
1-N,1-N-diethyl-2-N-(4-propan-2-yloxypyrimidin-2-yl)propane-1,2-diamine
CID 112637409
N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxyaniline
CID 63098725
6-ethoxy-N-[1-(furan-2-yl)propan-2-yl]pyridin-2-amine
CID 55212585
N-[1-(furan-2-yl)propan-2-yl]pyridin-4-amine
CID 61043048
4-propan-2-yloxy-N-(1-pyridin-3-ylethyl)pyrimidin-2-amine
CID 112636707
N-[(5-methylfuran-2-yl)methyl]-4-propan-2-yloxypyrimidin-2-amine
CID 112637500
N-[1-(furan-2-yl)propan-2-yl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine
CID 80896927

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine?
The IUPAC name of N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine (CID 112636994) is N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine.
What is the SMILES notation for N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine?
The canonical SMILES for N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine is CC(Cc1ccco1)Nc1nccc(OC(C)C)n1.
What is the InChIKey of N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine?
The InChIKey is ROWBYQFKHMEQRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-10(2)19-13-6-7-15-14(17-13)16-11(3)9-12-5-4-8-18-12/h4-8,10-11H,9H2,1-3H3,(H,15,16,17).
What are the key properties of N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine?
N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine has a molecular weight of 261.32 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)propan-2-yl]-4-propan-2-yloxypyrimidin-2-amine is sourced from PubChem (CID 112636994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).