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

C16H28N2O2 — CID 62462065

IUPACN-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
SMILESCCC(C)N(CCOC)Cc1occc1CNC1CC1
InChIInChI=1S/C16H28N2O2/c1-4-13(2)18(8-10-19-3)12-16-14(7-9-20-16)11-17-15-5-6-15/h7,9,13,15,17H,4-6,8,10-12H2,1-3H3
InChIKeyDCIHFIRFZYNPBR-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.78
Rot. Bonds10

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

N-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine (PubChem CID 62462065) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
PubChem CID62462065
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC NameN-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
SMILESCCC(C)N(CCOC)Cc1occc1CNC1CC1
InChIInChI=1S/C16H28N2O2/c1-4-13(2)18(8-10-19-3)12-16-14(7-9-20-16)11-17-15-5-6-15/h7,9,13,15,17H,4-6,8,10-12H2,1-3H3
InChIKeyDCIHFIRFZYNPBR-UHFFFAOYSA-N
XLogP2.78
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

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Related Compounds

N-[[2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 62435969
N-[[2-[[2-methoxyethyl(prop-2-enyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 103340346
N-[[3-[[2-methoxyethyl(methyl)amino]methyl]furan-2-yl]methyl]cyclopropanamine
CID 62447659
N-[[2-(methoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62444084
N-[[2-(butan-2-yloxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62454822
N-[[2-[[ethyl(propyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 62421778
N'-[[3-[(cyclopropylamino)methyl]furan-2-yl]methyl]-N,N,N'-trimethylethane-1,2-diamine
CID 63701262
N'-[[3-[(cyclopropylamino)methyl]furan-2-yl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 62436711
N-[[2-[[methyl(2-methylbutan-2-yl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 63967417
N-[[3-(3-methoxypropoxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62442427
N-butan-2-yl-4-[(cyclopropylamino)methyl]-3-fluoro-N-(2-methoxyethyl)pyridin-2-amine
CID 105389566
N-[[2-[[cyclobutylmethyl(methyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine
CID 62854572

Frequently Asked Questions

What is the IUPAC name of N-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine (CID 62462065) is N-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine is CCC(C)N(CCOC)Cc1occc1CNC1CC1.
What is the InChIKey of N-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine?
The InChIKey is DCIHFIRFZYNPBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-4-13(2)18(8-10-19-3)12-16-14(7-9-20-16)11-17-15-5-6-15/h7,9,13,15,17H,4-6,8,10-12H2,1-3H3.
What are the key properties of N-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine?
N-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine has a molecular weight of 280.41 g/mol, XLogP of 2.78, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[[butan-2-yl(2-methoxyethyl)amino]methyl]furan-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62462065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).