N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine

C15H26N2O — CID 62425577

IUPACN-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine
SMILESCCN(Cc1ccoc1CNC)C1CCCCC1
InChIInChI=1S/C15H26N2O/c1-3-17(14-7-5-4-6-8-14)12-13-9-10-18-15(13)11-16-2/h9-10,14,16H,3-8,11-12H2,1-2H3
InChIKeyHEXARGMDYQRIIO-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.15
Rot. Bonds6

About N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine

N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine (PubChem CID 62425577) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine.

Molecular Properties

Compound NameN-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine
PubChem CID62425577
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine
SMILESCCN(Cc1ccoc1CNC)C1CCCCC1
InChIInChI=1S/C15H26N2O/c1-3-17(14-7-5-4-6-8-14)12-13-9-10-18-15(13)11-16-2/h9-10,14,16H,3-8,11-12H2,1-2H3
InChIKeyHEXARGMDYQRIIO-UHFFFAOYSA-N
XLogP3.15
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-[(cyclopropylamino)methyl]furan-3-yl]methyl]-N-ethylcyclopentanamine
CID 62422317
N,2-dimethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexan-1-amine
CID 62461344
N-[[2-(ethylaminomethyl)furan-3-yl]methyl]-N-methylcyclopentanamine
CID 55074631
N-[[3-(aminomethyl)furan-2-yl]methyl]-N-ethylcyclopropanamine
CID 62420146
N-methyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]thiolan-3-amine
CID 62422601
N-[[2-[(tert-butylamino)methyl]furan-3-yl]methyl]-N-methylcyclopentanamine
CID 62417012
N-[[2-(ethylaminomethyl)furan-3-yl]methyl]-N-(2,2,2-trifluoroethyl)cyclopropanamine
CID 55073867
N-[[3-[[butyl(cyclopropyl)amino]methyl]furan-2-yl]methyl]cyclopropanamine
CID 62431615
1-[3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-ylmethyl)furan-2-yl]-N-methylmethanamine
CID 115562260
N-[[3-(ethylaminomethyl)furan-2-yl]methyl]-N-methylcyclopentanamine
CID 62417583
N-methyl-N-[[2-[(2-methylpropylamino)methyl]furan-3-yl]methyl]cyclopentanamine
CID 62419680
N-[[3-[[cyclopropyl(cyclopropylmethyl)amino]methyl]furan-2-yl]methyl]cyclopropanamine
CID 64522663

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine?
The IUPAC name of N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine (CID 62425577) is N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine.
What is the SMILES notation for N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine?
The canonical SMILES for N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine is CCN(Cc1ccoc1CNC)C1CCCCC1.
What is the InChIKey of N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine?
The InChIKey is HEXARGMDYQRIIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-3-17(14-7-5-4-6-8-14)12-13-9-10-18-15(13)11-16-2/h9-10,14,16H,3-8,11-12H2,1-2H3.
What are the key properties of N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine?
N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine has a molecular weight of 250.39 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]cyclohexanamine is sourced from PubChem (CID 62425577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).