N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine

C18H24N2O — CID 62411812

IUPACN-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine
SMILESCc1cccc(CN(C)Cc2cc(CNC3CC3)co2)c1
InChIInChI=1S/C18H24N2O/c1-14-4-3-5-15(8-14)11-20(2)12-18-9-16(13-21-18)10-19-17-6-7-17/h3-5,8-9,13,17,19H,6-7,10-12H2,1-2H3
InChIKeyZGCLFEBINZBQGT-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.47
Rot. Bonds7

About N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine

N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine (PubChem CID 62411812) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine
PubChem CID62411812
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine
SMILESCc1cccc(CN(C)Cc2cc(CNC3CC3)co2)c1
InChIInChI=1S/C18H24N2O/c1-14-4-3-5-15(8-14)11-20(2)12-18-9-16(13-21-18)10-19-17-6-7-17/h3-5,8-9,13,17,19H,6-7,10-12H2,1-2H3
InChIKeyZGCLFEBINZBQGT-UHFFFAOYSA-N
XLogP3.47
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-[[cyclopropyl(methyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 62418527
N-[[5-[[2,2-dimethylpropyl(methyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 62462274
N-[(3-methylphenyl)methyl]cyclopropanamine
CID 16776498
N-[[4-[(cyclopropylamino)methyl]furan-2-yl]methyl]-N-methylaniline
CID 62438694
N-[[4-[(cyclopropylamino)methyl]furan-2-yl]methyl]-N,1-dimethylpiperidin-4-amine
CID 62423916
N-[[4-[(cyclopropylamino)methyl]furan-2-yl]methyl]-4-fluoro-N-methylaniline
CID 62436053
N-[[5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 81067967
N-[[5-[(dipropylamino)methyl]furan-3-yl]methyl]cyclopropanamine
CID 62438391
N-[[5-[[methyl-[[2-(methylaminomethyl)furan-3-yl]methyl]amino]methyl]furan-3-yl]methyl]cyclopentanamine
CID 123405857
N-[[5-[[bis(2-methylpropyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 62426609
N-[[3-[[methyl(oxan-4-ylmethyl)amino]methyl]phenyl]methyl]cyclopropanamine
CID 63706317
N,3-dimethyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]aniline
CID 62436032

Frequently Asked Questions

What is the IUPAC name of N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine (CID 62411812) is N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine is Cc1cccc(CN(C)Cc2cc(CNC3CC3)co2)c1.
What is the InChIKey of N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine?
The InChIKey is ZGCLFEBINZBQGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-14-4-3-5-15(8-14)11-20(2)12-18-9-16(13-21-18)10-19-17-6-7-17/h3-5,8-9,13,17,19H,6-7,10-12H2,1-2H3.
What are the key properties of N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine?
N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine has a molecular weight of 284.40 g/mol, XLogP of 3.47, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[[methyl-[(3-methylphenyl)methyl]amino]methyl]furan-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62411812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).