N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine

C16H28N2O2 — CID 62434875

IUPACN-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine
SMILESCOCCN(Cc1ccc(CNCC(C)C)o1)C1CC1
InChIInChI=1S/C16H28N2O2/c1-13(2)10-17-11-15-6-7-16(20-15)12-18(8-9-19-3)14-4-5-14/h6-7,13-14,17H,4-5,8-12H2,1-3H3
InChIKeyXXPREZMQUUSZFF-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.64
Rot. Bonds10

About N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine

N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine (PubChem CID 62434875) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine
PubChem CID62434875
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC NameN-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine
SMILESCOCCN(Cc1ccc(CNCC(C)C)o1)C1CC1
InChIInChI=1S/C16H28N2O2/c1-13(2)10-17-11-15-6-7-16(20-15)12-18(8-9-19-3)14-4-5-14/h6-7,13-14,17H,4-5,8-12H2,1-3H3
InChIKeyXXPREZMQUUSZFF-UHFFFAOYSA-N
XLogP2.64
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 ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine
CID 62431088
N-(cyclopropylmethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine
CID 64520094
N-ethyl-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopentanamine
CID 62422313
N-[(5-bromofuran-2-yl)methyl]-N-(2-methoxyethyl)cyclopropanamine
CID 100614298
N-[[5-(methylaminomethyl)furan-2-yl]methyl]-N-(3-methylbutyl)cyclopropanamine
CID 78989912
2-methyl-N-[[5-[(2-methylcyclohexyl)oxymethyl]furan-2-yl]methyl]propan-1-amine
CID 62443568
N-[[5-(methylaminomethyl)furan-2-yl]methyl]-N-(2-methylpropyl)cyclopropanamine
CID 62429023
N-cyclopropyl-N-(2-methoxyethyl)-6-[(2-methylpropylamino)methyl]pyridazin-3-amine
CID 62292853
N,3-dimethyl-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]butan-1-amine
CID 62462201
N-(furan-2-ylmethyl)-N-(2-methoxyethyl)cyclopropanamine
CID 47023472
N,3,3-trimethyl-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]butan-2-amine
CID 62426314
2-methyl-N-[[5-(pentoxymethyl)furan-2-yl]methyl]propan-1-amine
CID 62449718

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine (CID 62434875) is N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine is COCCN(Cc1ccc(CNCC(C)C)o1)C1CC1.
What is the InChIKey of N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine?
The InChIKey is XXPREZMQUUSZFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-13(2)10-17-11-15-6-7-16(20-15)12-18(8-9-19-3)14-4-5-14/h6-7,13-14,17H,4-5,8-12H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine?
N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine has a molecular weight of 280.41 g/mol, XLogP of 2.64, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62434875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).