N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine

C14H24N2O — CID 62439401

IUPACN-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine
SMILESCCN(CC)Cc1cc(CNC2CC2)oc1C
InChIInChI=1S/C14H24N2O/c1-4-16(5-2)10-12-8-14(17-11(12)3)9-15-13-6-7-13/h8,13,15H,4-7,9-10H2,1-3H3
InChIKeyLFRZYYZJLFBYMW-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.68
Rot. Bonds7

About N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine

N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine (PubChem CID 62439401) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine
PubChem CID62439401
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine
SMILESCCN(CC)Cc1cc(CNC2CC2)oc1C
InChIInChI=1S/C14H24N2O/c1-4-16(5-2)10-12-8-14(17-11(12)3)9-15-13-6-7-13/h8,13,15H,4-7,9-10H2,1-3H3
InChIKeyLFRZYYZJLFBYMW-UHFFFAOYSA-N
XLogP2.68
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-5-methylfuran-2-yl]methyl]cyclopropanamine
CID 62426990
N-[[4-[[ethyl(methyl)amino]methyl]-5-methylfuran-2-yl]methyl]cyclopropanamine
CID 62419504
N-[[4-[[cyclopropyl(propyl)amino]methyl]-5-methylfuran-2-yl]methyl]cyclopropanamine
CID 62421982
N-[[5-[(cyclopropylamino)methyl]-2-methylfuran-3-yl]methyl]-N,1-dimethylpiperidin-4-amine
CID 62423023
N-[[4-(methoxymethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine
CID 62445621
N-[[5-[(cyclopropylamino)methyl]-2-methylfuran-3-yl]methyl]-N,2-dimethyloxolan-3-amine
CID 82754162
N-[[5-[(cyclopropylamino)methyl]-2-methylfuran-3-yl]methyl]-N,3-dimethylaniline
CID 62434975
N-[[5-[(cyclopropylamino)methyl]-2-methylfuran-3-yl]methyl]-2-fluoro-N-methylaniline
CID 62435269
N-[[5-methyl-4-[[methyl(1-thiophen-2-ylethyl)amino]methyl]furan-2-yl]methyl]cyclopropanamine
CID 62430120
N-[[4-[[cyclobutylmethyl(ethyl)amino]methyl]-5-methylfuran-2-yl]methyl]-2-methylpropan-2-amine
CID 107402017
N-[[5-methyl-4-[(3,4,5-trimethylpyrazol-1-yl)methyl]furan-2-yl]methyl]cyclopropanamine
CID 62443312
N-[[5-methyl-4-[(4-methyl-1,4-diazepan-1-yl)methyl]furan-2-yl]methyl]cyclopropanamine
CID 62417298

Frequently Asked Questions

What is the IUPAC name of N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine (CID 62439401) is N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine is CCN(CC)Cc1cc(CNC2CC2)oc1C.
What is the InChIKey of N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine?
The InChIKey is LFRZYYZJLFBYMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-16(5-2)10-12-8-14(17-11(12)3)9-15-13-6-7-13/h8,13,15H,4-7,9-10H2,1-3H3.
What are the key properties of N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine?
N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine has a molecular weight of 236.36 g/mol, XLogP of 2.68, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(diethylaminomethyl)-5-methylfuran-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62439401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).