N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine

C11H13N3O2 — CID 114600435

IUPACN-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine
SMILESCOc1cnc(NCCc2ccco2)nc1
InChIInChI=1S/C11H13N3O2/c1-15-10-7-13-11(14-8-10)12-5-4-9-3-2-6-16-9/h2-3,6-8H,4-5H2,1H3,(H,12,13,14)
InChIKeyGBTDDGFLZAYNMX-UHFFFAOYSA-N
MW219.24 g/mol
LogP1.73
Rot. Bonds5

About N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine

N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine (PubChem CID 114600435) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine.

Molecular Properties

Compound NameN-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine
PubChem CID114600435
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC NameN-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine
SMILESCOc1cnc(NCCc2ccco2)nc1
InChIInChI=1S/C11H13N3O2/c1-15-10-7-13-11(14-8-10)12-5-4-9-3-2-6-16-9/h2-3,6-8H,4-5H2,1H3,(H,12,13,14)
InChIKeyGBTDDGFLZAYNMX-UHFFFAOYSA-N
XLogP1.73
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(furan-2-yl)propyl]-4-methoxyaniline;hydrochloride
CID 71444012
2-(furan-2-ylmethylamino)-N-[2-(4-methoxyphenyl)ethyl]pyrimidine-5-carboxamide
CID 109255066
N-[2-(3-fluorophenyl)ethyl]-5-methoxypyrimidin-2-amine
CID 114600378
4-chloro-6-ethoxy-N-[2-(furan-2-yl)ethyl]-1,3,5-triazin-2-amine
CID 62857408
4-N-[2-(furan-2-yl)ethyl]-2-N,2-N-dimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80781292
2-[2-(furan-2-yl)ethylamino]-4-methoxybenzoic acid
CID 81305282
6-chloro-4-N-ethyl-2-N-[2-(furan-2-yl)ethyl]-1,3,5-triazine-2,4-diamine
CID 80802955
5-methoxy-N-(3-methylbutyl)pyrimidin-2-amine
CID 114600318
2-N,2-N-diethyl-4-N-[2-(furan-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine
CID 80804048
2-(furan-2-yl)-5-N-[2-(furan-2-yl)ethyl]-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145436762
6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine
CID 66328978
5-ethyl-4-N-[2-(furan-2-yl)ethyl]-6-N-methylpyrimidine-4,6-diamine
CID 80804231

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine?
The IUPAC name of N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine (CID 114600435) is N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine.
What is the SMILES notation for N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine?
The canonical SMILES for N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine is COc1cnc(NCCc2ccco2)nc1.
What is the InChIKey of N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine?
The InChIKey is GBTDDGFLZAYNMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2/c1-15-10-7-13-11(14-8-10)12-5-4-9-3-2-6-16-9/h2-3,6-8H,4-5H2,1H3,(H,12,13,14).
What are the key properties of N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine?
N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine has a molecular weight of 219.24 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)ethyl]-5-methoxypyrimidin-2-amine is sourced from PubChem (CID 114600435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).