1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine

C14H18N2O — CID 43726592

IUPAC1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine
SMILESCC(Nc1ccccc1N(C)C)c1ccco1
InChIInChI=1S/C14H18N2O/c1-11(14-9-6-10-17-14)15-12-7-4-5-8-13(12)16(2)3/h4-11,15H,1-3H3
InChIKeyFPBBYLZWQNQOBD-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.52
Rot. Bonds4

About 1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine

1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine (PubChem CID 43726592) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine.

Molecular Properties

Compound Name1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine
PubChem CID43726592
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine
SMILESCC(Nc1ccccc1N(C)C)c1ccco1
InChIInChI=1S/C14H18N2O/c1-11(14-9-6-10-17-14)15-12-7-4-5-8-13(12)16(2)3/h4-11,15H,1-3H3
InChIKeyFPBBYLZWQNQOBD-UHFFFAOYSA-N
XLogP3.52
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-[1-(furan-2-yl)ethyl]aniline
CID 43194896
N-[[2-[1-(furan-2-yl)ethylamino]phenyl]methyl]-N-methylacetamide
CID 43692114
1-N-[1-(furan-2-yl)ethyl]-4-N,4-N,2-trimethylbenzene-1,4-diamine
CID 43677033
2-[1-[2-(dimethylamino)anilino]ethyl]benzene-1,3-diol
CID 107710686
(1S)-2-[[(1R)-1-[2-(dimethylamino)phenyl]ethyl]amino]-1-(furan-2-yl)ethanol
CID 97160729
1-N,2-N,2-N-trimethylbenzene-1,2-diamine
CID 533455
2,3,4-trifluoro-N-[1-(furan-2-yl)ethyl]aniline
CID 43192518
2-[[2-[1-(furan-2-yl)ethylamino]phenyl]hydrazinylidene]propanedinitrile
CID 169341274
2-[2-[1-(furan-2-yl)ethylamino]phenyl]sulfanylacetamide
CID 43722596
N-[1-(furan-2-yl)ethyl]cinnolin-4-amine
CID 55213775
2-N-[(1S)-1-(furan-2-yl)ethyl]-4-N-methyl-4-N-phenylpyrimidine-2,4-diamine
CID 155969385
2-chloro-6-[1-(furan-2-yl)ethylamino]benzenecarbothioamide
CID 55079374

Frequently Asked Questions

What is the IUPAC name of 1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine?
The IUPAC name of 1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine (CID 43726592) is 1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine.
What is the SMILES notation for 1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine?
The canonical SMILES for 1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine is CC(Nc1ccccc1N(C)C)c1ccco1.
What is the InChIKey of 1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine?
The InChIKey is FPBBYLZWQNQOBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-11(14-9-6-10-17-14)15-12-7-4-5-8-13(12)16(2)3/h4-11,15H,1-3H3.
What are the key properties of 1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine?
1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine has a molecular weight of 230.31 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-[1-(furan-2-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine is sourced from PubChem (CID 43726592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).