N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine

C17H30N2O2 — CID 62448984

IUPACN-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
SMILESCCC(CC)N(CCOC)Cc1cc(CNC2CC2)co1
InChIInChI=1S/C17H30N2O2/c1-4-16(5-2)19(8-9-20-3)12-17-10-14(13-21-17)11-18-15-6-7-15/h10,13,15-16,18H,4-9,11-12H2,1-3H3
InChIKeyXIBQVXRLCFUEPB-UHFFFAOYSA-N
MW294.44 g/mol
LogP3.17
Rot. Bonds11

About N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine

N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine (PubChem CID 62448984) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
PubChem CID62448984
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC NameN-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
SMILESCCC(CC)N(CCOC)Cc1cc(CNC2CC2)co1
InChIInChI=1S/C17H30N2O2/c1-4-16(5-2)19(8-9-20-3)12-17-10-14(13-21-17)11-18-15-6-7-15/h10,13,15-16,18H,4-9,11-12H2,1-3H3
InChIKeyXIBQVXRLCFUEPB-UHFFFAOYSA-N
XLogP3.17
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine with MolForge

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Related Compounds

N-[[5-[[2-methylpropyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 79490038
N-[[5-[[2-methoxyethyl(2-methylpropyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 62430853
N-[[5-[(dipropylamino)methyl]furan-3-yl]methyl]cyclopropanamine
CID 62438391
N-[[5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 81067967
N-[[5-[[bis(2-methylpropyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 62426609
N-[[5-[[cyclopropyl(methyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 62418527
N-[[5-[2-(dimethylamino)ethoxymethyl]furan-3-yl]methyl]cyclopropanamine
CID 62460736
N-[[5-(butoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62451891
N-[[5-(propan-2-yloxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62456702
N-[[5-[[2,2-dimethylpropyl(methyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 62462274
N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine
CID 62434699
N-[[4-[(cyclopropylamino)methyl]furan-2-yl]methyl]-N-methylaniline
CID 62438694

Frequently Asked Questions

What is the IUPAC name of N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine (CID 62448984) is N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine is CCC(CC)N(CCOC)Cc1cc(CNC2CC2)co1.
What is the InChIKey of N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine?
The InChIKey is XIBQVXRLCFUEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-4-16(5-2)19(8-9-20-3)12-17-10-14(13-21-17)11-18-15-6-7-15/h10,13,15-16,18H,4-9,11-12H2,1-3H3.
What are the key properties of N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine?
N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine has a molecular weight of 294.44 g/mol, XLogP of 3.17, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62448984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).