2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine

C14H20N4O — CID 80803462

IUPAC2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine
SMILESCCNc1nc(C)cc(NC(C)Cc2ccco2)n1
InChIInChI=1S/C14H20N4O/c1-4-15-14-17-11(3)9-13(18-14)16-10(2)8-12-6-5-7-19-12/h5-7,9-10H,4,8H2,1-3H3,(H2,15,16,17,18)
InChIKeyXXWKHKQYOCEKRC-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.85
Rot. Bonds6

About 2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine

2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine (PubChem CID 80803462) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine
PubChem CID80803462
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine
SMILESCCNc1nc(C)cc(NC(C)Cc2ccco2)n1
InChIInChI=1S/C14H20N4O/c1-4-15-14-17-11(3)9-13(18-14)16-10(2)8-12-6-5-7-19-12/h5-7,9-10H,4,8H2,1-3H3,(H2,15,16,17,18)
InChIKeyXXWKHKQYOCEKRC-UHFFFAOYSA-N
XLogP2.85
TPSA62.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-ethyl-6-methyl-4-N-[1-(5-methylfuran-2-yl)ethyl]pyrimidine-2,4-diamine
CID 80801180
N-ethyl-4-(furan-2-ylmethylsulfanyl)-6-methylpyrimidin-2-amine
CID 80893163
1-(furan-2-yl)-N-[1-(furan-2-yl)propan-2-yl]propan-2-amine
CID 55179966
4-N-[1-(furan-2-yl)propan-2-yl]-6-methoxypyrimidine-2,4-diamine
CID 114053032
4-N-[1-(furan-2-yl)propan-2-yl]-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114564446
2-N-ethyl-6-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-2,4-diamine
CID 80801697
N-[1-(furan-2-yl)propan-2-yl]-5-methylpyridin-3-amine
CID 107584649
N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine
CID 80896852
4-N-(furan-2-ylmethyl)-6-methyl-2-N-(pyridin-4-ylmethyl)pyrimidine-2,4-diamine
CID 112915129
4-N-(furan-2-ylmethyl)-6-methyl-2-N-[(4-methylphenyl)methyl]pyrimidine-2,4-diamine
CID 112915116
5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine
CID 115773907
6-ethoxy-N-[1-(furan-2-yl)propan-2-yl]pyridin-2-amine
CID 55212585

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine?
The IUPAC name of 2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine (CID 80803462) is 2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine.
What is the SMILES notation for 2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine?
The canonical SMILES for 2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine is CCNc1nc(C)cc(NC(C)Cc2ccco2)n1.
What is the InChIKey of 2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine?
The InChIKey is XXWKHKQYOCEKRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-4-15-14-17-11(3)9-13(18-14)16-10(2)8-12-6-5-7-19-12/h5-7,9-10H,4,8H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine?
2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine has a molecular weight of 260.34 g/mol, XLogP of 2.85, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine is sourced from PubChem (CID 80803462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).